2-[[3-(4-methoxyphenyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[3-(4-methoxyphenyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-isobutyl-3-(4-methoxyphenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[3-(4-methoxyphenyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[3-(4-methoxyphenyl)-4-(2-methylpropyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[4-isobutyl-3-(4-methoxyphenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide Formula: C20H31N5O2S MolecularWeight: 405.55744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN(C1=S)CN(C)CC(=O)NC(C)C)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CN1C(=NN(C1=S)CN(C)CC(=O)NC(C)C)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H31N5O2S/c1-14(2)11-24-19(16-7-9-17(27-6)10-8-16)22-25(20(24)28)13-23(5)12-18(26)21-15(3)4/h7-10,14-15H,11-13H2,1-6H3,(H,21,26)