5-cyano-2-methyl-N-phenyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-2-methyl-N-phenyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-allylsulfanyl-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-N-phenyl-6-(prop-2-enylthio)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-2-methyl-N-phenyl-6-prop-2-enylsulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(allylthio)-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H19N3OS2/c1-3-11-27-21-16(13-22)19(17-10-7-12-26-17)18(14(2)23-21)20(25)24-15-8-5-4-6-9-15/h3-10,12,19,23H,1,11H2,2H3,(H,24,25)