N-[2-(4-propan-2-yloxyphenyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[2-(4-propan-2-yloxyphenyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[2-(4-isopropoxyphenyl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[2-(4-propan-2-yloxyphenyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[2-(4-propan-2-yloxyphenyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(4-isopropoxyphenyl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CCNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CCNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C20H24N4O2S2/c1-14(2)26-16-7-5-15(6-8-16)9-11-21-18(25)10-12-24-19(22-23-20(24)27)17-4-3-13-28-17/h3-8,13-14H,9-12H2,1-2H3,(H,21,25)(H,23,27)