N,N-dimethyl-4-[[4-phenethyl-5-sulfanylidene-3-(thiophen-2-ylmethyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide

Systemtic Name: N,N-dimethyl-4-[[4-phenethyl-5-sulfanylidene-3-(thiophen-2-ylmethyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Openeye Name: N,N-dimethyl-4-[[4-phenethyl-3-(2-thienylmethyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide CAS Name: N,N-dimethyl-4-[[4-phenethyl-5-sulfanylidene-3-(thiophen-2-ylmethyl)-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxamide IUPAC Name: N,N-dimethyl-4-[[4-phenethyl-5-sulfanylidene-3-(thiophen-2-ylmethyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Traditional Name: N,N-dimethyl-4-[[4-phenethyl-3-(2-thenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Formula: C23H30N6OS2 MolecularWeight: 470.6539

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)CC3=CC=CS3)CCC4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)CC3=CC=CS3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H30N6OS2/c1-25(2)22(30)27-14-12-26(13-15-27)18-29-23(31)28(11-10-19-7-4-3-5-8-19)21(24-29)17-20-9-6-16-32-20/h3-9,16H,10-15,17-18H2,1-2H3