CAS RN: 13608-26-9
CAS Name: 4,4-dimethyl-6-(methylthio)-1,2,3,9-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 4,4-dimethyl-6-methylsulfanyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
IUPAC Name: 4,4-dimethyl-6-methylsulfanyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 4,4-dimethyl-6-methylsulfanyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C14H18N2S
MOLECULAR WEIGHT: 246.37112
SMILES: CC1(CNCC2=C1C3=C(N2)C=CC(=C3)SC)C
Structure:
CAS RN: 13608-25-8
CAS Name: 4-methyl-6-(methylthio)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 4-methyl-6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 4-methyl-6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 4-methyl-6-methylsulfanyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C13H16N2S
MOLECULAR WEIGHT: 232.34454
SMILES: CC1CNCC2=C1C3=C(N2)C=CC(=C3)SC
Structure:
CAS RN: 13608-23-6
CAS Name: 6-methoxy-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 6-methoxy-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
IUPAC Name: 6-methoxy-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 6-methoxy-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C14H18N2O
MOLECULAR WEIGHT: 230.30552
SMILES: CC1(CNCC2=C1C3=C(N2)C=CC(=C3)OC)C
Structure:
CAS RN: 13608-22-5
CAS Name: 6-methoxy-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-methoxy-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-methoxy-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-methoxy-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C13H16N2O
MOLECULAR WEIGHT: 216.27894
SMILES: CC1CNCC2=C1C3=C(N2)C=CC(=C3)OC
Structure:
CAS RN: 13608-21-4
CAS Name: 6-methoxy-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-methoxy-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-methoxy-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-methoxy-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C13H16N2O
MOLECULAR WEIGHT: 216.27894
SMILES: CC1CC2=C(CN1)NC3=C2C=C(C=C3)OC
Structure:
CAS RN: 13608-20-3
CAS Name: 6-bromo-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 6-bromo-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
IUPAC Name: 6-bromo-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 6-bromanyl-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C13H15BrN2
MOLECULAR WEIGHT: 279.1756
SMILES: CC1(CNCC2=C1C3=C(N2)C=CC(=C3)Br)C
Structure:
CAS RN: 13608-19-0
CAS Name: 6-bromo-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-bromo-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-bromo-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-bromanyl-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C12H13BrN2
MOLECULAR WEIGHT: 265.14902
SMILES: CC1CNCC2=C1C3=C(N2)C=CC(=C3)Br
Structure:
CAS RN: 13608-18-9
CAS Name: 6-bromo-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-bromo-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-bromo-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-bromanyl-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C12H13BrN2
MOLECULAR WEIGHT: 265.14902
SMILES: CC1CC2=C(CN1)NC3=C2C=C(C=C3)Br
Structure:
CAS RN: 13608-17-8
CAS Name: 6-chloro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 6-chloro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
IUPAC Name: 6-chloro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 6-chloranyl-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C13H15ClN2
MOLECULAR WEIGHT: 234.7246
SMILES: CC1(CNCC2=C1C3=C(N2)C=CC(=C3)Cl)C
Structure:
CAS RN: 13608-16-7
CAS Name: 6-chloro-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-chloro-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-chloro-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-chloranyl-4-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C12H13ClN2
MOLECULAR WEIGHT: 220.69802
SMILES: CC1CNCC2=C1C3=C(N2)C=CC(=C3)Cl
Structure:
CAS RN: 13608-14-5
CAS Name: 6-fluoro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
OPENEYE Name: 6-fluoro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
IUPAC Name: 6-fluoro-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
SYSTEMATIC NAME: 6-fluoranyl-4,4-dimethyl-1,2,3,9-tetrahydropyrido[3,4-b]indole
MOLECULAR FORMULA: C13H15FN2
MOLECULAR WEIGHT: 218.270003
SMILES: CC1(CNCC2=C1C3=C(N2)C=CC(=C3)F)C
Structure:
CAS RN: 13608-13-4
CAS Name: 6-fluoro-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
OPENEYE Name: 6-fluoro-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
IUPAC Name: 6-fluoro-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-fluoranyl-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C12H13FN2
MOLECULAR WEIGHT: 204.243423
SMILES: CC1CC2=C(CN1)NC3=C2C=C(C=C3)F
Structure:
CAS RN: 13606-94-5
CAS Name: N-(2-pyridinyl)propanamide
OPENEYE Name: N-(2-pyridyl)propanamide
IUPAC Name: N-pyridin-2-ylpropanamide
SYSTEMATIC NAME: N-pyridin-2-ylpropanamide
MOLECULAR FORMULA: C8H10N2O
MOLECULAR WEIGHT: 150.1778
SMILES: CCC(=O)NC1=CC=CC=N1
Structure:
CAS RN: 13604-44-9
CAS Name: 4-[[4-(dimethylamino)phenyl]thio]-N,N-dimethylaniline
OPENEYE Name: 4-[4-(dimethylamino)phenyl]sulfanyl-N,N-dimethyl-aniline
IUPAC Name: 4-[4-(dimethylamino)phenyl]sulfanyl-N,N-dimethylaniline
SYSTEMATIC NAME: 4-[4-(dimethylamino)phenyl]sulfanyl-N,N-dimethyl-aniline
MOLECULAR FORMULA: C16H20N2S
MOLECULAR WEIGHT: 272.4084
SMILES: CN(C)C1=CC=C(C=C1)SC2=CC=C(C=C2)N(C)C
Structure:
CAS RN: 13603-10-6
CAS Name: 3-ethylpiperidine
OPENEYE Name: 3-ethylpiperidine
IUPAC Name: 3-ethylpiperidine
SYSTEMATIC NAME: 3-ethylpiperidine
MOLECULAR FORMULA: C7H15N
MOLECULAR WEIGHT: 113.2007
SMILES: CCC1CCCNC1
Structure:
CAS RN: 13597-11-0
CAS Name: 1,4-bis(ethylthio)-2-butyne
OPENEYE Name: 1,4-bis(ethylsulfanyl)but-2-yne
IUPAC Name: 1,4-bis(ethylsulfanyl)but-2-yne
SYSTEMATIC NAME: 1,4-bis(ethylsulfanyl)but-2-yne
MOLECULAR FORMULA: C8H14S2
MOLECULAR WEIGHT: 174.32676
SMILES: CCSCC#CCSCC
Structure:
CAS RN: 13593-08-3
CAS Name: dimethoxy-(2-quinoxalinyloxy)-sulfanylidenephosphorane
OPENEYE Name: dimethoxy-quinoxalin-2-yloxy-thioxo-$l^{5}-phosphane
IUPAC Name: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C10H11N2O3PS
MOLECULAR WEIGHT: 270.244701
SMILES: COP(=S)(OC)OC1=NC2=CC=CC=C2N=C1
Structure:
CAS RN: 58318-99-3
CAS Name: dimethoxy-(2-quinoxalinyloxy)-sulfanylidenephosphorane
OPENEYE Name: dimethoxy-quinoxalin-2-yloxy-thioxo-$l^{5}-phosphane
IUPAC Name: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C10H11N2O3PS
MOLECULAR WEIGHT: 270.244701
SMILES: COP(=S)(OC)OC1=NC2=CC=CC=C2N=C1
Structure:
CAS RN: 65862-97-7
CAS Name: dimethoxy-(2-quinoxalinyloxy)-sulfanylidenephosphorane
OPENEYE Name: dimethoxy-quinoxalin-2-yloxy-thioxo-$l^{5}-phosphane
IUPAC Name: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: dimethoxy-quinoxalin-2-yloxy-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C10H11N2O3PS
MOLECULAR WEIGHT: 270.244701
SMILES: COP(=S)(OC)OC1=NC2=CC=CC=C2N=C1
Structure:
CAS RN: 13591-48-5
CAS Name: 5-bromo-3-ethyl-5-nitro-1,3-oxazinane hydrochloride
OPENEYE Name: 5-bromo-3-ethyl-5-nitro-1,3-oxazinane hydrochloride
IUPAC Name: 5-bromo-3-ethyl-5-nitro-1,3-oxazinane hydrochloride
SYSTEMATIC NAME: 5-bromanyl-3-ethyl-5-nitro-1,3-oxazinane hydrochloride
MOLECULAR FORMULA: C6H12BrClN2O3
MOLECULAR WEIGHT: 275.52808
SMILES: CCN1CC(COC1)([N+](=O)[O-])Br.Cl
Structure:
CAS RN: 13591-47-4
CAS Name: 5-bromo-3-methyl-5-nitro-1,3-oxazinane hydrobromide
OPENEYE Name: 5-bromo-3-methyl-5-nitro-1,3-oxazinane hydrobromide
IUPAC Name: 5-bromo-3-methyl-5-nitro-1,3-oxazinane hydrobromide
SYSTEMATIC NAME: 5-bromanyl-3-methyl-5-nitro-1,3-oxazinane hydrobromide
MOLECULAR FORMULA: C5H10Br2N2O3
MOLECULAR WEIGHT: 305.9525
SMILES: CN1CC(COC1)([N+](=O)[O-])Br.Br
Structure:
CAS RN: 13587-57-0
CAS Name: N-(3-methylphenyl)benzenesulfonamide
OPENEYE Name: N-(m-tolyl)benzenesulfonamide
IUPAC Name: N-(3-methylphenyl)benzenesulfonamide
SYSTEMATIC NAME: N-(3-methylphenyl)benzenesulfonamide
MOLECULAR FORMULA: C13H13NO2S
MOLECULAR WEIGHT: 247.31282
SMILES: CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC=C2
Structure:
CAS RN: 13586-52-2
CAS Name: 1-(5-phenyl-3-isoxazolyl)-3-(1-piperidinyl)-1-propanol hydrochloride
OPENEYE Name: 1-(5-phenylisoxazol-3-yl)-3-(1-piperidyl)propan-1-ol hydrochloride
IUPAC Name: 1-(5-phenyl-1,2-oxazol-3-yl)-3-piperidin-1-ylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 1-(5-phenyl-1,2-oxazol-3-yl)-3-piperidin-1-yl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C17H23ClN2O2
MOLECULAR WEIGHT: 322.82972
SMILES: C1CCN(CC1)CCC(C2=NOC(=C2)C3=CC=CC=C3)O.Cl
Structure:
CAS RN: 13578-58-0
CAS Name: N-ethyl-4,5-dihydrothiazol-2-amine
OPENEYE Name: N-ethyl-4,5-dihydrothiazol-2-amine
IUPAC Name: N-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SYSTEMATIC NAME: N-ethyl-4,5-dihydro-1,3-thiazol-2-amine
MOLECULAR FORMULA: C5H10N2S
MOLECULAR WEIGHT: 130.2113
SMILES: CCNC1=NCCS1
Structure:
CAS RN: 13577-46-3
CAS Name: 4-chloronaphthalene-1,8-dicarboxylic acid
OPENEYE Name: 4-chloronaphthalene-1,8-dicarboxylic acid
IUPAC Name: 4-chloronaphthalene-1,8-dicarboxylic acid
SYSTEMATIC NAME: 4-chloranylnaphthalene-1,8-dicarboxylic acid
MOLECULAR FORMULA: C12H7ClO4
MOLECULAR WEIGHT: 250.63458
SMILES: C1=CC2=C(C=CC(=C2C(=C1)C(=O)O)C(=O)O)Cl
Structure:
CAS RN: 13576-85-7
CAS Name: 2-(4-methoxyphenyl)ethylurea
OPENEYE Name: 2-(4-methoxyphenyl)ethylurea
IUPAC Name: 2-(4-methoxyphenyl)ethylurea
SYSTEMATIC NAME: 1-[2-(4-methoxyphenyl)ethyl]urea
MOLECULAR FORMULA: C10H14N2O2
MOLECULAR WEIGHT: 194.23036
SMILES: COC1=CC=C(C=C1)CCNC(=O)N
Structure:
CAS RN: 13574-98-6
CAS Name: 6-fluoro-4-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
OPENEYE Name: 6-fluoro-4-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
IUPAC Name: 6-fluoro-4-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
SYSTEMATIC NAME: 6-fluoranyl-4-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
MOLECULAR FORMULA: C18H18ClFN2
MOLECULAR WEIGHT: 316.800323
SMILES: CC1CNC(C2=C1C3=C(N2)C=CC(=C3)F)C4=CC=CC=C4.Cl
Structure:
CAS RN: 13574-93-1
CAS Name: 3-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
OPENEYE Name: 3-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
IUPAC Name: 3-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
SYSTEMATIC NAME: 3-methyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
MOLECULAR FORMULA: C18H19ClN2
MOLECULAR WEIGHT: 298.80986
SMILES: CC1CC2=C(C(N1)C3=CC=CC=C3)NC4=CC=CC=C24.Cl
Structure:
CAS RN: 13574-91-9
CAS Name: 3-methyl-6-(methylthio)-1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
OPENEYE Name: 3-methyl-6-methylsulfanyl-1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
IUPAC Name: 3-methyl-6-methylsulfanyl-1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
SYSTEMATIC NAME: 3-methyl-6-methylsulfanyl-1-(3,4,5-trimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
MOLECULAR FORMULA: C22H27ClN2O3S
MOLECULAR WEIGHT: 434.97938
SMILES: CC1CC2=C(C(N1)C3=CC(=C(C(=C3)OC)OC)OC)NC4=C2C=C(C=C4)SC.Cl
Structure:
CAS RN: 13574-90-8
CAS Name: 3-methyl-6-(methylthio)-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
OPENEYE Name: 3-methyl-6-methylsulfanyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
IUPAC Name: 3-methyl-6-methylsulfanyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
SYSTEMATIC NAME: 3-methyl-6-methylsulfanyl-1-phenyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
MOLECULAR FORMULA: C19H21ClN2S
MOLECULAR WEIGHT: 344.90144
SMILES: CC1CC2=C(C(N1)C3=CC=CC=C3)NC4=C2C=C(C=C4)SC.Cl
Structure:
CAS RN: 13571-18-1
CAS Name: O-(1-phenylpropan-2-yl)hydroxylamine hydrochloride
OPENEYE Name: O-(1-methyl-2-phenyl-ethyl)hydroxylamine hydrochloride
IUPAC Name: O-(1-phenylpropan-2-yl)hydroxylamine hydrochloride
SYSTEMATIC NAME: O-(1-phenylpropan-2-yl)hydroxylamine hydrochloride
MOLECULAR FORMULA: C9H14ClNO
MOLECULAR WEIGHT: 187.66656
SMILES: CC(CC1=CC=CC=C1)ON.Cl
Structure:
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