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

Systemtic Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazino]-(2-thienyl)methanone Formula: C16H23N5OS2 MolecularWeight: 365.51672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=S)N(N1)CN2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=NC(=S)N(N1)CN2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C16H23N5OS2/c1-16(2,3)14-17-15(23)21(18-14)11-19-6-8-20(9-7-19)13(22)12-5-4-10-24-12/h4-5,10H,6-9,11H2,1-3H3,(H,17,18,23)