CAS RN: 54997-74-9
CAS Name: 1-(3-cyclopentyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine; methanesulfonic acid
OPENEYE Name: 1-(3-cyclopentyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; methanesulfonic acid
IUPAC Name: 1-(3-cyclopentyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine; methanesulfonic acid
SYSTEMATIC NAME: 1-(3-cyclopentyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; methanesulfonic acid
MOLECULAR FORMULA: C26H38N2O6S3
MOLECULAR WEIGHT: 570.78472
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=C(C=C4)C5CCCC5.CS(=O)(=O)O.CS(=O)(=O)O
Structure:
CAS RN: 54997-58-9
CAS Name: methanesulfonic acid; 1-methyl-4-(3-propan-2-yl-5-benzo[b][1]benzothiepinyl)piperazine
OPENEYE Name: 1-(3-isopropylbenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; methanesulfonic acid
IUPAC Name: methanesulfonic acid; 1-methyl-4-(3-propan-2-ylbenzo[b][1]benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: methanesulfonic acid; 1-methyl-4-(3-propan-2-ylbenzo[b][1]benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C23H30N2O3S2
MOLECULAR WEIGHT: 446.6259
SMILES: CC(C)C1=CC2=C(C=C1)SC3=CC=CC=C3C=C2N4CCN(CC4)C.CS(=O)(=O)O
Structure:
CAS RN: 54997-53-4
CAS Name: 3-[4-(3-ethyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinyl]-1-propanol; methanesulfonic acid
OPENEYE Name: 3-[4-(3-ethyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol; methanesulfonic acid
IUPAC Name: 3-[4-(3-ethyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol; methanesulfonic acid
SYSTEMATIC NAME: 3-[4-(3-ethyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol; methanesulfonic acid
MOLECULAR FORMULA: C25H38N2O7S3
MOLECULAR WEIGHT: 574.77342
SMILES: CCC1=CC2=C(C=C1)SC3=CC=CC=C3CC2N4CCN(CC4)CCCO.CS(=O)(=O)O.CS(=O)(=O)O
Structure:
CAS RN: 54996-17-7
CAS Name: 4-amino-N-(6-chloro-1,5-naphthyridin-2-yl)benzenesulfonamide
OPENEYE Name: 4-amino-N-(6-chloro-1,5-naphthyridin-2-yl)benzenesulfonamide
IUPAC Name: 4-amino-N-(6-chloro-1,5-naphthyridin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(6-chloranyl-1,5-naphthyridin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C14H11ClN4O2S
MOLECULAR WEIGHT: 334.78074
SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=NC3=C(C=C2)N=C(C=C3)Cl
Structure:
CAS RN: 54996-16-6
CAS Name: 4-amino-N-(1,5-naphthyridin-2-yl)benzenesulfonamide
OPENEYE Name: 4-amino-N-(1,5-naphthyridin-2-yl)benzenesulfonamide
IUPAC Name: 4-amino-N-(1,5-naphthyridin-2-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-azanyl-N-(1,5-naphthyridin-2-yl)benzenesulfonamide
MOLECULAR FORMULA: C14H12N4O2S
MOLECULAR WEIGHT: 300.33568
SMILES: C1=CC2=C(C=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N)N=C1
Structure:
CAS RN: 54995-95-8
CAS Name: 1-(3,4-dihydro-1H-benzofuro[3,2-c]pyridin-2-yl)-3-(1-piperidinyl)-1-propanone hydrochloride
OPENEYE Name: 1-(3,4-dihydro-1H-benzofuro[3,2-c]pyridin-2-yl)-3-(1-piperidyl)propan-1-one hydrochloride
IUPAC Name: 1-(3,4-dihydro-1H-[1]benzofuro[3,2-c]pyridin-2-yl)-3-piperidin-1-ylpropan-1-one hydrochloride
SYSTEMATIC NAME: 1-(3,4-dihydro-1H-[1]benzofuro[3,2-c]pyridin-2-yl)-3-piperidin-1-yl-propan-1-one hydrochloride
MOLECULAR FORMULA: C19H25ClN2O2
MOLECULAR WEIGHT: 348.867
SMILES: C1CCN(CC1)CCC(=O)N2CCC3=C(C2)C4=CC=CC=C4O3.Cl
Structure:
CAS RN: 54987-88-1
CAS Name: 2-[4-(2-methoxyphenyl)-4-phenyl-1-piperazin-4-iumyl]-N-phenylacetamide dihydrochloride
OPENEYE Name: 2-[4-(2-methoxyphenyl)-4-phenyl-piperazin-4-ium-1-yl]-N-phenyl-acetamide dihydrochloride
IUPAC Name: 2-[4-(2-methoxyphenyl)-4-phenylpiperazin-4-ium-1-yl]-N-phenylacetamide dihydrochloride
SYSTEMATIC NAME: 2-[4-(2-methoxyphenyl)-4-phenyl-piperazin-4-ium-1-yl]-N-phenyl-ethanamide dihydrochloride
MOLECULAR FORMULA: C25H30Cl2N3O2+
MOLECULAR WEIGHT: 475.4306
SMILES: COC1=CC=CC=C1[N+]2(CCN(CC2)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl
Structure:
CAS RN: 54978-24-4
CAS Name: 3-amino-6-methyl-1,2-dihydro-1,2,4,5-tetrazepin-7-one hydrochloride
OPENEYE Name: 3-amino-6-methyl-1,2-dihydro-1,2,4,5-tetrazepin-7-one hydrochloride
IUPAC Name: 3-amino-6-methyl-1,2-dihydro-1,2,4,5-tetrazepin-7-one hydrochloride
SYSTEMATIC NAME: 3-azanyl-6-methyl-1,2-dihydro-1,2,4,5-tetrazepin-7-one hydrochloride
MOLECULAR FORMULA: C4H8ClN5O
MOLECULAR WEIGHT: 177.59222
SMILES: CC1=NN=C(NNC1=O)N.Cl
Structure:
CAS RN: 54978-23-3
CAS Name: 3-amino-1,4-dihydro-1,2,4,5-tetrazepin-7-one dihydrochloride
OPENEYE Name: 3-amino-1,4-dihydro-1,2,4,5-tetrazepin-7-one dihydrochloride
IUPAC Name: 3-amino-1,4-dihydro-1,2,4,5-tetrazepin-7-one dihydrochloride
SYSTEMATIC NAME: 3-azanyl-1,4-dihydro-1,2,4,5-tetrazepin-7-one dihydrochloride
MOLECULAR FORMULA: C3H7Cl2N5O
MOLECULAR WEIGHT: 200.02658
SMILES: C1=NNC(=NNC1=O)N.Cl.Cl
Structure:
CAS RN: 54969-17-4
CAS Name: 11-[2-(1-pyrrolidinyl)ethyl]-2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazine hydrochloride
OPENEYE Name: 11-(2-pyrrolidin-1-ylethyl)-2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazine hydrochloride
IUPAC Name: 11-(2-pyrrolidin-1-ylethyl)-2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazine hydrochloride
SYSTEMATIC NAME: 11-(2-pyrrolidin-1-ylethyl)-2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazine hydrochloride
MOLECULAR FORMULA: C20H28ClF3N2S
MOLECULAR WEIGHT: 420.96293
SMILES: C1CCC2C(CC1)SC3=C(N2CCN4CCCC4)C=C(C=C3)C(F)(F)F.Cl
Structure:
CAS RN: 54969-12-9
CAS Name: N,N-diethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
OPENEYE Name: N,N-diethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
IUPAC Name: N,N-diethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-diethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
MOLECULAR FORMULA: C20H30ClF3N2S
MOLECULAR WEIGHT: 422.97881
SMILES: CCN(CC)CCN1C2CCCCCC2SC3=C1C=C(C=C3)C(F)(F)F.Cl
Structure:
CAS RN: 54969-10-7
CAS Name: N,N-dimethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
OPENEYE Name: N,N-dimethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
IUPAC Name: N,N-dimethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-2-[2-(trifluoromethyl)-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl]ethanamine hydrochloride
MOLECULAR FORMULA: C18H26ClF3N2S
MOLECULAR WEIGHT: 394.92565
SMILES: CN(C)CCN1C2CCCCCC2SC3=C1C=C(C=C3)C(F)(F)F.Cl
Structure:
CAS RN: 54969-09-4
CAS Name: 2-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethylethanamine hydrochloride
OPENEYE Name: 2-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethyl-ethanamine hydrochloride
IUPAC Name: 2-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethylethanamine hydrochloride
SYSTEMATIC NAME: 2-(2-chloranyl-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethyl-ethanamine hydrochloride
MOLECULAR FORMULA: C17H26Cl2N2S
MOLECULAR WEIGHT: 361.37274
SMILES: CN(C)CCN1C2CCCCCC2SC3=C1C=C(C=C3)Cl.Cl
Structure:
CAS RN: 54969-07-2
CAS Name: 3-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethyl-1-propanamine hydrochloride
OPENEYE Name: 3-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethyl-propan-1-amine hydrochloride
IUPAC Name: 3-(2-chloro-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethylpropan-1-amine hydrochloride
SYSTEMATIC NAME: 3-(2-chloranyl-6,7,8,9,10,10a-hexahydro-5aH-cyclohepta[b][1,4]benzothiazin-11-yl)-N,N-dimethyl-propan-1-amine hydrochloride
MOLECULAR FORMULA: C18H28Cl2N2S
MOLECULAR WEIGHT: 375.39932
SMILES: CN(C)CCCN1C2CCCCCC2SC3=C1C=C(C=C3)Cl.Cl
Structure:
CAS RN: 54955-21-4
CAS Name: (2S)-2-acetamido-4-(methylthio)butanoic acid; (2S)-2,5-diaminopentanoic acid
OPENEYE Name: (2S)-2-acetamido-4-methylsulfanyl-butanoic acid; (2S)-2,5-diaminopentanoic acid
IUPAC Name: (2S)-2-acetamido-4-methylsulfanylbutanoic acid; (2S)-2,5-diaminopentanoic acid
SYSTEMATIC NAME: (2S)-2-acetamido-4-methylsulfanyl-butanoic acid; (2S)-2,5-bis(azanyl)pentanoic acid
MOLECULAR FORMULA: C12H25N3O5S
MOLECULAR WEIGHT: 323.409
SMILES: CC(=O)N[C@@H](CCSC)C(=O)O.C(C[C@@H](C(=O)O)N)CN
Structure:
CAS RN: 54955-20-3
CAS Name: (2S)-2-acetamido-4-(methylthio)butanoic acid; (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid
OPENEYE Name: (2S)-2-acetamido-4-methylsulfanyl-butanoic acid; (2S)-2-amino-5-guanidino-pentanoic acid
IUPAC Name: (2S)-2-acetamido-4-methylsulfanylbutanoic acid; (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid
SYSTEMATIC NAME: (2S)-2-acetamido-4-methylsulfanyl-butanoic acid; (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid
MOLECULAR FORMULA: C13H27N5O5S
MOLECULAR WEIGHT: 365.44898
SMILES: CC(=O)N[C@@H](CCSC)C(=O)O.C(C[C@@H](C(=O)O)N)CN=C(N)N
Structure:
CAS RN: 54955-08-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H19ClN2
MOLECULAR WEIGHT: 262.77776
SMILES: C1CCC2=C3C(C1)NCCN3C4=CC=CC=C24.Cl
Structure:
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