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

Systemtic Name: 3-[4-ethyl-1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-ethyl-1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-ethyl-1-[[4-(4-methoxyphenyl)-1-piperazinyl]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-ethyl-1-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-ethyl-1-[[4-(4-methoxyphenyl)piperazino]methyl]-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C19H28N6O2S MolecularWeight: 404.52962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)CCC(=O)N

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)OC)CCC(=O)N

InChI

InChI=1S/C19H28N6O2S/c1-3-24-18(9-8-17(20)26)21-25(19(24)28)14-22-10-12-23(13-11-22)15-4-6-16(27-2)7-5-15/h4-7H,3,8-14H2,1-2H3,(H2,20,26)