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

Systemtic Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-cyclopropyl-methanone Openeye Name: [4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-cyclopropyl-methanone CAS Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]-1-piperazinyl]-cyclopropylmethanone IUPAC Name: [4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-cyclopropylmethanone Traditional Name: [4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazino]-cyclopropyl-methanone Formula: C15H25N5OS MolecularWeight: 323.4569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=S)N(N1)CN2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

CC(C)(C)C1=NC(=S)N(N1)CN2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C15H25N5OS/c1-15(2,3)13-16-14(22)20(17-13)10-18-6-8-19(9-7-18)12(21)11-4-5-11/h11H,4-10H2,1-3H3,(H,16,17,22)