ethyl 6-cyano-2-[[5-[(4-methylphenyl)methyl]furan-2-yl]carbonylamino]-6-phenyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-cyano-2-[[5-[(4-methylphenyl)methyl]furan-2-yl]carbonylamino]-6-phenyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-cyano-6-phenyl-2-[[5-(p-tolylmethyl)furan-2-carbonyl]amino]-5,7-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 6-cyano-2-[[[5-[(4-methylphenyl)methyl]-2-furanyl]-oxomethyl]amino]-6-phenyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-cyano-2-[[5-[(4-methylphenyl)methyl]furan-2-carbonyl]amino]-6-phenyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 6-cyano-2-[[5-(4-methylbenzyl)-2-furoyl]amino]-6-phenyl-5,7-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C31H28N2O4S MolecularWeight: 524.63002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)(C#N)C3=CC=CC=C3)NC(=O)C4=CC=C(O4)CC5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)(C#N)C3=CC=CC=C3)NC(=O)C4=CC=C(O4)CC5=CC=C(C=C5)C

InChI

InChI=1S/C31H28N2O4S/c1-3-36-30(35)27-24-15-16-31(19-32,22-7-5-4-6-8-22)18-26(24)38-29(27)33-28(34)25-14-13-23(37-25)17-21-11-9-20(2)10-12-21/h4-14H,3,15-18H2,1-2H3,(H,33,34)