6-azanyl-4-(4-chlorophenyl)-5-cyano-N-phenyl-2-prop-2-enylsulfanyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 6-azanyl-4-(4-chlorophenyl)-5-cyano-N-phenyl-2-prop-2-enylsulfanyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 2-allylsulfanyl-6-amino-4-(4-chlorophenyl)-5-cyano-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 6-amino-4-(4-chlorophenyl)-5-cyano-N-phenyl-2-(prop-2-enylthio)-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-amino-4-(4-chlorophenyl)-5-cyano-N-phenyl-2-prop-2-enylsulfanyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 2-(allylthio)-6-amino-4-(4-chlorophenyl)-5-cyano-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C22H19ClN4OS MolecularWeight: 422.93046

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C(C(=C(N1)N)C#N)C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C=CCSC1=C(C(C(=C(N1)N)C#N)C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H19ClN4OS/c1-2-12-29-22-19(21(28)26-16-6-4-3-5-7-16)18(17(13-24)20(25)27-22)14-8-10-15(23)11-9-14/h2-11,18,27H,1,12,25H2,(H,26,28)