N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-N-methyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)C(=O)CCN2C(=NNC2=S)C3=CC=CS3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)C(=O)CCN2C(=NNC2=S)C3=CC=CS3)OC

InChI

InChI=1S/C20H24N4O3S2/c1-4-27-15-8-7-14(12-16(15)26-3)13-23(2)18(25)9-10-24-19(21-22-20(24)28)17-6-5-11-29-17/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,22,28)