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

Systemtic Name: (4-methoxyphenyl)-[4-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: (4-methoxyphenyl)-[4-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]piperazin-1-yl]methanone CAS Name: (4-methoxyphenyl)-[4-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-methoxyphenyl)-[4-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: (4-methoxyphenyl)-[4-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]piperazino]methanone Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)CN3C(=S)N=C(N3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)CN3C(=S)N=C(N3)C4=CC=CS4

InChI

InChI=1S/C19H21N5O2S2/c1-26-15-6-4-14(5-7-15)18(25)23-10-8-22(9-11-23)13-24-19(27)20-17(21-24)16-3-2-12-28-16/h2-7,12H,8-11,13H2,1H3,(H,20,21,27)