6-azanyl-3-[[6-azanyl-5-carbamothioyl-4-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-3,4-dihydropyridin-3-yl]carbonyl]-4-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-3,4-dihydropyridine-5-carbothioamide

Systemtic Name: 6-azanyl-3-[[6-azanyl-5-carbamothioyl-4-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-3,4-dihydropyridin-3-yl]carbonyl]-4-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-3,4-dihydropyridine-5-carbothioamide Openeye Name: 6-amino-3-[6-amino-5-carbamothioyl-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridine-3-carbonyl]-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridine-5-carbothioamide CAS Name: 6-amino-3-[[6-amino-5-carbamothioyl-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridin-3-yl]-oxomethyl]-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridine-5-carbothioamide IUPAC Name: 6-amino-3-[6-amino-5-carbamothioyl-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridine-3-carbonyl]-4-(4-methoxyphenyl)-2-oxo-1-phenyl-3,4-dihydropyridine-5-carbothioamide Traditional Name: 6-amino-3-[6-amino-2-keto-4-(4-methoxyphenyl)-1-phenyl-5-thiocarbamoyl-3,4-dihydropyridine-3-carbonyl]-2-keto-4-(4-methoxyphenyl)-1-phenyl-3,4-dihydropyridine-5-carbothioamide Formula: C39H36N6O5S2 MolecularWeight: 732.87034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)N(C(=C2C(=S)N)N)C3=CC=CC=C3)C(=O)C4C(C(=C(N(C4=O)C5=CC=CC=C5)N)C(=S)N)C6=CC=C(C=C6)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C(=O)N(C(=C2C(=S)N)N)C3=CC=CC=C3)C(=O)C4C(C(=C(N(C4=O)C5=CC=CC=C5)N)C(=S)N)C6=CC=C(C=C6)OC

InChI

InChI=1S/C39H36N6O5S2/c1-49-25-17-13-21(14-18-25)27-29(38(47)44(23-9-5-3-6-10-23)34(40)31(27)36(42)51)33(46)30-28(22-15-19-26(50-2)20-16-22)32(37(43)52)35(41)45(39(30)48)24-11-7-4-8-12-24/h3-20,27-30H,40-41H2,1-2H3,(H2,42,51)(H2,43,52)