N-(2-chlorophenyl)-3-[3-(2-methoxyphenyl)-4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[3-(2-methoxyphenyl)-4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[4-isopropyl-3-(2-methoxyphenyl)-5-thioxo-1,2,4-triazol-1-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[3-(2-methoxyphenyl)-4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[3-(2-methoxyphenyl)-4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[4-isopropyl-3-(2-methoxyphenyl)-5-thioxo-1,2,4-triazol-1-yl]propionamide Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN(C1=S)CCC(=O)NC2=CC=CC=C2Cl)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)N1C(=NN(C1=S)CCC(=O)NC2=CC=CC=C2Cl)C3=CC=CC=C3OC

InChI

InChI=1S/C21H23ClN4O2S/c1-14(2)26-20(15-8-4-7-11-18(15)28-3)24-25(21(26)29)13-12-19(27)23-17-10-6-5-9-16(17)22/h4-11,14H,12-13H2,1-3H3,(H,23,27)