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

Systemtic Name: 3-[1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[1-[[4-(4-methoxyphenyl)piperazino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C18H26N6O2S MolecularWeight: 390.50304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)CCC(=O)N

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)CCC(=O)N

InChI

InChI=1S/C18H26N6O2S/c1-21-17(8-7-16(19)25)20-24(18(21)27)13-22-9-11-23(12-10-22)14-3-5-15(26-2)6-4-14/h3-6H,7-13H2,1-2H3,(H2,19,25)