N-(6-imidazol-1-ylpyridin-3-yl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(6-imidazol-1-ylpyridin-3-yl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(6-imidazol-1-yl-3-pyridyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[6-(1-imidazolyl)-3-pyridinyl]-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(6-imidazol-1-ylpyridin-3-yl)-3-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(6-imidazol-1-yl-3-pyridyl)-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H19N7OS MolecularWeight: 405.47616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NC3=CN=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CCC(=O)NC3=CN=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C20H19N7OS/c1-14-3-2-4-15(11-14)19-24-25-20(29)27(19)9-7-18(28)23-16-5-6-17(22-12-16)26-10-8-21-13-26/h2-6,8,10-13H,7,9H2,1H3,(H,23,28)(H,25,29)