N-[3-[3-cyclopropyl-5-(2-oxidanylidenecyclohexyl)sulfanyl-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-cyclopropyl-5-(2-oxidanylidenecyclohexyl)sulfanyl-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-cyclopropyl-5-(2-oxocyclohexyl)sulfanyl-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-cyclopropyl-5-[(2-oxocyclohexyl)thio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-cyclopropyl-5-(2-oxocyclohexyl)sulfanyl-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-cyclopropyl-5-[(2-ketocyclohexyl)thio]-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SC3CCCCC3=O)C4CC4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SC3CCCCC3=O)C4CC4

InChI

InChI=1S/C19H22N4O2S/c1-12(24)20-14-5-4-6-15(11-14)23-18(13-9-10-13)21-22-19(23)26-17-8-3-2-7-16(17)25/h4-6,11,13,17H,2-3,7-10H2,1H3,(H,20,24)