1-[4-[(3,4-dicyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one

Systemtic Name: 1-[4-[(3,4-dicyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one Openeye Name: 1-[4-[(3,4-dicyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one CAS Name: 1-[4-[(3,4-dicyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]-2-methyl-2-phenyl-1-propanone IUPAC Name: 1-[4-[(3,4-dicyclopropyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-2-methyl-2-phenylpropan-1-one Traditional Name: 1-[4-[(3,4-dicyclopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-2-methyl-2-phenyl-propan-1-one Formula: C23H31N5OS MolecularWeight: 425.59014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=S)N(C(=N3)C4CC4)C5CC5

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=S)N(C(=N3)C4CC4)C5CC5

InChI

InChI=1S/C23H31N5OS/c1-23(2,18-6-4-3-5-7-18)21(29)26-14-12-25(13-15-26)16-27-22(30)28(19-10-11-19)20(24-27)17-8-9-17/h3-7,17,19H,8-16H2,1-2H3