CAS RN: 6823-17-2
CAS Name: 1-[6-methyl-1-phenyl-4-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-sulfanylidene-5-pyrimidinyl]ethanone
OPENEYE Name: 1-[4-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-1-phenyl-2-thioxo-pyrimidin-5-yl]ethanone
IUPAC Name: 1-[4-(4-benzylpiperazin-4-ium-1-yl)-6-methyl-1-phenyl-2-sulfanylidenepyrimidin-5-yl]ethanone
SYSTEMATIC NAME: 1-[6-methyl-1-phenyl-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2-sulfanylidene-pyrimidin-5-yl]ethanone
MOLECULAR FORMULA: C24H27N4OS+
MOLECULAR WEIGHT: 419.56238
SMILES: CC1=C(C(=NC(=S)N1C2=CC=CC=C2)N3CC[NH+](CC3)CC4=CC=CC=C4)C(=O)C
Structure:
CAS RN: 6911-24-6
CAS Name: N-(2-furanylmethyl)-3-(4-methoxyphenyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide
OPENEYE Name: N-(2-furylmethyl)-3-(4-methoxyphenyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
IUPAC Name: N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
SYSTEMATIC NAME: N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
MOLECULAR FORMULA: C24H24N4O4S
MOLECULAR WEIGHT: 464.53676
SMILES: COC1=CC=C(C=C1)C2=NC(=NN2)SC(CC(=O)NCC3=CC=CO3)C4=CC=C(C=C4)OC
Structure:
CAS RN: 6562-29-4
CAS Name: 3,4-dichloro-N-(thiophen-2-ylmethylideneamino)aniline
OPENEYE Name: 3,4-dichloro-N-(2-thienylmethyleneamino)aniline
IUPAC Name: 3,4-dichloro-N-(thiophen-2-ylmethylideneamino)aniline
SYSTEMATIC NAME: 3,4-bis(chloranyl)-N-(thiophen-2-ylmethylideneamino)aniline
MOLECULAR FORMULA: C11H8Cl2N2S
MOLECULAR WEIGHT: 271.16562
SMILES: C1=CSC(=C1)C=NNC2=CC(=C(C=C2)Cl)Cl
Structure:
CAS RN: 6133-41-1
CAS Name: 4-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylidene-1-imidazolidinyl]benzoic acid ethyl ester
OPENEYE Name: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-thioxo-imidazolidin-1-yl]benzoate
IUPAC Name: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylideneimidazolidin-1-yl]benzoate
SYSTEMATIC NAME: ethyl 4-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-4-[2-oxidanylidene-2-[(4-propoxyphenyl)amino]ethyl]-2-sulfanylidene-imidazolidin-1-yl]benzoate
MOLECULAR FORMULA: C33H37N3O7S
MOLECULAR WEIGHT: 619.72778
SMILES: CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)C(=O)OCC
Structure:
CAS RN: 6129-12-0
CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(hex-5-en-2-ylideneamino)acetamide
OPENEYE Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(1-methylpent-4-enylideneamino)acetamide
IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(hex-5-en-2-ylideneamino)acetamide
SYSTEMATIC NAME: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(hex-5-en-2-ylideneamino)ethanamide
MOLECULAR FORMULA: C15H17N3O2S
MOLECULAR WEIGHT: 303.37938
SMILES: CC(=NNC(=O)CSC1=NC2=CC=CC=C2O1)CCC=C
Structure:
CAS RN: 6782-41-8
CAS Name: 2-(4-chlorophenyl)imino-5-(hydroxymethyl)-N-(4-methoxyphenyl)-8-methyl-3-pyrano[2,3-c]pyridinecarboxamide
OPENEYE Name: 2-(4-chlorophenyl)imino-5-(hydroxymethyl)-N-(4-methoxyphenyl)-8-methyl-pyrano[2,3-c]pyridine-3-carboxamide
IUPAC Name: 2-(4-chlorophenyl)imino-5-(hydroxymethyl)-N-(4-methoxyphenyl)-8-methylpyrano[2,3-c]pyridine-3-carboxamide
SYSTEMATIC NAME: 2-(4-chlorophenyl)imino-5-(hydroxymethyl)-N-(4-methoxyphenyl)-8-methyl-pyrano[2,3-c]pyridine-3-carboxamide
MOLECULAR FORMULA: C24H20ClN3O4
MOLECULAR WEIGHT: 449.8863
SMILES: CC1=NC=C(C2=C1OC(=NC3=CC=C(C=C3)Cl)C(=C2)C(=O)NC4=CC=C(C=C4)OC)CO
Structure:
CAS RN: 32745-92-9
CAS Name: 1-(9-anthracenyl)-N-(4-chlorophenyl)methanimine
OPENEYE Name: 1-(9-anthryl)-N-(4-chlorophenyl)methanimine
IUPAC Name: 1-anthracen-9-yl-N-(4-chlorophenyl)methanimine
SYSTEMATIC NAME: 1-anthracen-9-yl-N-(4-chlorophenyl)methanimine
MOLECULAR FORMULA: C21H14ClN
MOLECULAR WEIGHT: 315.79556
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=NC4=CC=C(C=C4)Cl
Structure:
CAS RN: 6529-18-6
CAS Name: 4-chloro-N-(2,6-dimethyl-4-pyrimidinyl)benzenesulfonamide
OPENEYE Name: 4-chloro-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide
IUPAC Name: 4-chloro-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide
SYSTEMATIC NAME: 4-chloranyl-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide
MOLECULAR FORMULA: C12H12ClN3O2S
MOLECULAR WEIGHT: 297.76058
SMILES: CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 6526-73-4
CAS Name: 3-cyclohexyl-1-[(4-nitrophenyl)methyl]-1-propylurea
OPENEYE Name: 3-cyclohexyl-1-[(4-nitrophenyl)methyl]-1-propyl-urea
IUPAC Name: 3-cyclohexyl-1-[(4-nitrophenyl)methyl]-1-propylurea
SYSTEMATIC NAME: 3-cyclohexyl-1-[(4-nitrophenyl)methyl]-1-propyl-urea
MOLECULAR FORMULA: C17H25N3O3
MOLECULAR WEIGHT: 319.3987
SMILES: CCCN(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NC2CCCCC2
Structure:
CAS RN: 6526-12-1
CAS Name: 1-cyclohexyl-3-[2-(4-fluorophenyl)ethyl]thiourea
OPENEYE Name: 1-cyclohexyl-3-[2-(4-fluorophenyl)ethyl]thiourea
IUPAC Name: 1-cyclohexyl-3-[2-(4-fluorophenyl)ethyl]thiourea
SYSTEMATIC NAME: 1-cyclohexyl-3-[2-(4-fluorophenyl)ethyl]thiourea
MOLECULAR FORMULA: C15H21FN2S
MOLECULAR WEIGHT: 280.404043
SMILES: C1CCC(CC1)NC(=S)NCCC2=CC=C(C=C2)F
Structure:
CAS RN: 6183-22-8
CAS Name: N-[[5-(phenacylthio)-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide
OPENEYE Name: N-[[5-phenacylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-phenyl-acetamide
IUPAC Name: N-[[5-phenacylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-phenylacetamide
SYSTEMATIC NAME: N-[[5-phenacylsulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-phenyl-ethanamide
MOLECULAR FORMULA: C26H21F3N4O2S
MOLECULAR WEIGHT: 510.53075
SMILES: C1=CC=C(C=C1)CC(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)C4=CC=CC=C4
Structure:
CAS RN: 6560-33-4
CAS Name: 2-(2,4,5-trichlorophenoxy)acetic acid [2-oxo-2-(1-phenylethylamino)ethyl] ester
OPENEYE Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-(2,4,5-trichlorophenoxy)acetate
IUPAC Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-(2,4,5-trichlorophenoxy)acetate
SYSTEMATIC NAME: [2-oxidanylidene-2-(1-phenylethylamino)ethyl] 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate
MOLECULAR FORMULA: C18H16Cl3NO4
MOLECULAR WEIGHT: 416.68294
SMILES: CC(C1=CC=CC=C1)NC(=O)COC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl
Structure:
CAS RN: 6065-49-2
CAS Name: 6a-(4-chlorophenyl)-8-(4-fluoroanilino)-6-(3-hydroxyphenyl)-2-propyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
OPENEYE Name: 6a-(4-chlorophenyl)-8-(4-fluoroanilino)-6-(3-hydroxyphenyl)-2-propyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC Name: 6a-(4-chlorophenyl)-8-(4-fluoroanilino)-6-(3-hydroxyphenyl)-2-propyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a-(4-chlorophenyl)-8-[(4-fluorophenyl)amino]-6-(3-hydroxyphenyl)-2-propyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C35H31ClFN3O5
MOLECULAR WEIGHT: 628.089143
SMILES: CCCN1C(=O)C2CC=C3C(C2C1=O)CC4C(=O)N(C(=O)C4(C3C5=CC(=CC=C5)O)C6=CC=C(C=C6)Cl)NC7=CC=C(C=C7)F
Structure:
CAS RN: 6075-76-9
CAS Name: 8-(3-chloro-4-fluorophenyl)-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-6-[5-(hydroxymethyl)-2-furanyl]-6a-methyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
OPENEYE Name: 8-(3-chloro-4-fluoro-phenyl)-2-[4-[2-(2,5-dimethoxyphenyl)vinyl]phenyl]-6-[5-(hydroxymethyl)-2-furyl]-6a-methyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC Name: 8-(3-chloro-4-fluorophenyl)-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-6-[5-(hydroxymethyl)furan-2-yl]-6a-methyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 8-(3-chloranyl-4-fluoranyl-phenyl)-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-6-[5-(hydroxymethyl)furan-2-yl]-6a-methyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C42H36ClFN2O8
MOLECULAR WEIGHT: 751.195243
SMILES: CC12C(CC3C4C(CC=C3C1C5=CC=C(O5)CO)C(=O)N(C4=O)C6=CC=C(C=C6)C=CC7=C(C=CC(=C7)OC)OC)C(=O)N(C2=O)C8=CC(=C(C=C8)F)Cl
Structure:
CAS RN: 6075-15-6
CAS Name: 6-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-(4-iodophenyl)-6a-methyl-8-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
OPENEYE Name: 6-(4-hydroxy-3-iodo-5-methoxy-phenyl)-2-(4-iodophenyl)-6a-methyl-8-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC Name: 6-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-(4-iodophenyl)-6a-methyl-8-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-2-(4-iodophenyl)-6a-methyl-8-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C34H28I2N2O6
MOLECULAR WEIGHT: 814.40486
SMILES: CC12C(CC3C4C(CC=C3C1C5=CC(=C(C(=C5)I)O)OC)C(=O)N(C4=O)C6=CC=C(C=C6)I)C(=O)N(C2=O)C7=CC=CC=C7
Structure:
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