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

Systemtic Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(2-methoxypyridin-4-yl)methyl]propanamide Openeye Name: 3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(2-methoxy-4-pyridyl)methyl]propanamide CAS Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(2-methoxy-4-pyridinyl)methyl]propanamide IUPAC Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(2-methoxypyridin-4-yl)methyl]propanamide Traditional Name: 3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(2-methoxy-4-pyridyl)methyl]propionamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=CC(=NC=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NCC3=CC(=NC=C3)OC

InChI

InChI=1S/C19H21N5O3S/c1-26-15-5-3-14(4-6-15)18-22-23-19(28)24(18)10-8-16(25)21-12-13-7-9-20-17(11-13)27-2/h3-7,9,11H,8,10,12H2,1-2H3,(H,21,25)(H,23,28)