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

Systemtic Name: 5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-N-phenyl-6-(propylthio)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-2-methyl-N-phenyl-6-propylsulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-2-methyl-N-phenyl-6-(propylthio)-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2)C3=CC=CS3)C#N

Isomeric SMILES

CCCSC1=C(C(C(=C(N1)C)C(=O)NC2=CC=CC=C2)C3=CC=CS3)C#N

InChI

InChI=1S/C21H21N3OS2/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/h4-10,12,19,23H,3,11H2,1-2H3,(H,24,25)