N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridinyl]methyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]methyl]-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C23H28N6OS MolecularWeight: 436.57302

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

Isomeric SMILES

CN1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3=CN=C(N3C4=CC=CC=C4)SC

InChI

InChI=1S/C23H28N6OS/c1-27-11-6-12-28(14-13-27)21-10-9-18(15-24-21)16-25-22(30)20-17-26-23(31-2)29(20)19-7-4-3-5-8-19/h3-5,7-10,15,17H,6,11-14,16H2,1-2H3,(H,25,30)