N,N-diethyl-4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide

Systemtic Name: N,N-diethyl-4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(4-benzyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: N,N-diethyl-4-[[3-methyl-4-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-benzyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[(4-benzyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C20H30N6OS MolecularWeight: 402.5568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C)CC3=CC=CC=C3

InChI

InChI=1S/C20H30N6OS/c1-4-23(5-2)19(27)24-13-11-22(12-14-24)16-26-20(28)25(17(3)21-26)15-18-9-7-6-8-10-18/h6-10H,4-5,11-16H2,1-3H3