3-methyl-N-(1-phenylethyl)-2-(1-phenylethylcarbamothioyl)imidazo[4,5-b]pyridine-6-carboxamide

Systemtic Name: 3-methyl-N-(1-phenylethyl)-2-(1-phenylethylcarbamothioyl)imidazo[4,5-b]pyridine-6-carboxamide Openeye Name: 3-methyl-N-(1-phenylethyl)-2-(1-phenylethylcarbamothioyl)imidazo[4,5-b]pyridine-6-carboxamide CAS Name: 3-methyl-N-(1-phenylethyl)-2-[(1-phenylethylamino)-sulfanylidenemethyl]-6-imidazo[4,5-b]pyridinecarboxamide IUPAC Name: 3-methyl-N-(1-phenylethyl)-2-(1-phenylethylcarbamothioyl)imidazo[4,5-b]pyridine-6-carboxamide Traditional Name: 3-methyl-N-(1-phenylethyl)-2-(1-phenylethylthiocarbamoyl)imidazo[4,5-b]pyridine-6-carboxamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(N=C2)N(C(=N3)C(=S)NC(C)C4=CC=CC=C4)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(N=C2)N(C(=N3)C(=S)NC(C)C4=CC=CC=C4)C

InChI

InChI=1S/C25H25N5OS/c1-16(18-10-6-4-7-11-18)27-24(31)20-14-21-22(26-15-20)30(3)23(29-21)25(32)28-17(2)19-12-8-5-9-13-19/h4-17H,1-3H3,(H,27,31)(H,28,32)