2-azanyl-1-(3-chloranyl-4-methyl-phenyl)-4-(5-ethyl-2-ethylsulfanyl-thiophen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-chloranyl-4-methyl-phenyl)-4-(5-ethyl-2-ethylsulfanyl-thiophen-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-chloro-4-methyl-phenyl)-4-(5-ethyl-2-ethylsulfanyl-3-thienyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(3-chloro-4-methylphenyl)-4-[5-ethyl-2-(ethylthio)-3-thiophenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-chloro-4-methylphenyl)-4-(5-ethyl-2-ethylsulfanylthiophen-3-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(3-chloro-4-methyl-phenyl)-4-[5-ethyl-2-(ethylthio)-3-thienyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H26ClN3OS2 MolecularWeight: 484.07644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)SCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)C)Cl)N)C#N

Isomeric SMILES

CCC1=CC(=C(S1)SCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=C(C=C4)C)Cl)N)C#N

InChI

InChI=1S/C25H26ClN3OS2/c1-4-16-12-17(25(32-16)31-5-2)22-18(13-27)24(28)29(15-10-9-14(3)19(26)11-15)20-7-6-8-21(30)23(20)22/h9-12,22H,4-8,28H2,1-3H3