N-[(2-methoxypyridin-3-yl)methyl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(2-methoxy-3-pyridinyl)methyl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-[(2-methoxy-3-pyridyl)methyl]-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=C(N=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=C(N=CC=C3)OC

InChI

InChI=1S/C19H21N5O2S/c1-13-5-7-14(8-6-13)17-22-23-19(27)24(17)11-9-16(25)21-12-15-4-3-10-20-18(15)26-2/h3-8,10H,9,11-12H2,1-2H3,(H,21,25)(H,23,27)