(4R)-2-butylsulfanyl-3-cyano-6-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide

Systemtic Name: (4R)-2-butylsulfanyl-3-cyano-6-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide Openeye Name: (4R)-2-butylsulfanyl-3-cyano-6-methyl-N-phenyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxamide CAS Name: (4R)-2-(butylthio)-3-cyano-6-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4R)-2-butylsulfanyl-3-cyano-6-methyl-N-phenyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4R)-2-(butylthio)-3-cyano-6-methyl-N-phenyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxamide Formula: C22H23N3OS2 MolecularWeight: 409.56752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=C(C(C1C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCCCSC1=NC(=C([C@@H](C1C#N)C2=CC=CS2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3OS2/c1-3-4-12-28-22-17(14-23)20(18-11-8-13-27-18)19(15(2)24-22)21(26)25-16-9-6-5-7-10-16/h5-11,13,17,20H,3-4,12H2,1-2H3,(H,25,26)/t17?,20-/m0/s1