2-azanyl-4-(2-ethylsulfanylthiophen-3-yl)-1-(2-methylphenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2-ethylsulfanylthiophen-3-yl)-1-(2-methylphenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2-ethylsulfanyl-3-thienyl)-1-(o-tolyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[2-(ethylthio)-3-thiophenyl]-1-(2-methylphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2-ethylsulfanylthiophen-3-yl)-1-(2-methylphenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[2-(ethylthio)-3-thienyl]-5-keto-1-(o-tolyl)-7-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C29H27N3OS2 MolecularWeight: 497.67418

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CS1)C2C(=C(N(C3=C2C(=O)CC(C3)C4=CC=CC=C4)C5=CC=CC=C5C)N)C#N

Isomeric SMILES

CCSC1=C(C=CS1)C2C(=C(N(C3=C2C(=O)CC(C3)C4=CC=CC=C4)C5=CC=CC=C5C)N)C#N

InChI

InChI=1S/C29H27N3OS2/c1-3-34-29-21(13-14-35-29)26-22(17-30)28(31)32(23-12-8-7-9-18(23)2)24-15-20(16-25(33)27(24)26)19-10-5-4-6-11-19/h4-14,20,26H,3,15-16,31H2,1-2H3