6-[2-(2-tert-butyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)ethylsulfanyl]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 6-[2-(2-tert-butyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)ethylsulfanyl]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-[2-(2-tert-butyl-4-oxo-4aH-quinazolin-3-ium-3-yl)ethylsulfanyl]-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 6-[2-(2-tert-butyl-4-oxo-4aH-quinazolin-3-ium-3-yl)ethylthio]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-[2-(2-tert-butyl-4-oxo-4aH-quinazolin-3-ium-3-yl)ethylsulfanyl]-5-cyano-2-methyl-N-phenyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-[2-(2-tert-butyl-4-keto-4aH-quinazolin-3-ium-3-yl)ethylthio]-5-cyano-2-methyl-N-phenyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxamide Formula: C32H32N5O2S2+ MolecularWeight: 582.75878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC[N+]2=C(N=C3C=CC=CC3C2=O)C(C)(C)C)C#N)C4=CC=CS4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC[N+]2=C(N=C3C=CC=CC3C2=O)C(C)(C)C)C#N)C4=CC=CS4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C32H31N5O2S2/c1-20-26(28(38)35-21-11-6-5-7-12-21)27(25-15-10-17-40-25)23(19-33)29(34-20)41-18-16-37-30(39)22-13-8-9-14-24(22)36-31(37)32(2,3)4/h5-15,17,22,27H,16,18H2,1-4H3,(H-,34,35,38)/p+1