N-butyl-2-[4-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[(4-cyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[(4-cyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[(4-cyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]acetamide Formula: C16H28N6OS MolecularWeight: 352.49812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C=N2)C3CC3

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)CN2C(=S)N(C=N2)C3CC3

InChI

InChI=1S/C16H28N6OS/c1-2-3-6-17-15(23)11-19-7-9-20(10-8-19)13-22-16(24)21(12-18-22)14-4-5-14/h12,14H,2-11,13H2,1H3,(H,17,23)