N-(2-imidazol-1-ylethyl)-2-[methyl-(phenylmethyl)amino]-6-thiophen-3-yl-pyridine-3-carboxamide

Systemtic Name: N-(2-imidazol-1-ylethyl)-2-[methyl-(phenylmethyl)amino]-6-thiophen-3-yl-pyridine-3-carboxamide Openeye Name: 2-[benzyl(methyl)amino]-N-(2-imidazol-1-ylethyl)-6-(3-thienyl)pyridine-3-carboxamide CAS Name: N-[2-(1-imidazolyl)ethyl]-2-[methyl-(phenylmethyl)amino]-6-(3-thiophenyl)-3-pyridinecarboxamide IUPAC Name: 2-[benzyl(methyl)amino]-N-(2-imidazol-1-ylethyl)-6-thiophen-3-ylpyridine-3-carboxamide Traditional Name: 2-[benzyl(methyl)amino]-N-(2-imidazol-1-ylethyl)-6-(3-thienyl)nicotinamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C(C=CC(=N2)C3=CSC=C3)C(=O)NCCN4C=CN=C4

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C(C=CC(=N2)C3=CSC=C3)C(=O)NCCN4C=CN=C4

InChI

InChI=1S/C23H23N5OS/c1-27(15-18-5-3-2-4-6-18)22-20(7-8-21(26-22)19-9-14-30-16-19)23(29)25-11-13-28-12-10-24-17-28/h2-10,12,14,16-17H,11,13,15H2,1H3,(H,25,29)