3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C20H28N6OS MolecularWeight: 400.54092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H28N6OS/c1-15(2)19-22-23-20(26(19)16-6-7-16)28-14-8-18(27)25-12-10-24(11-13-25)17-5-3-4-9-21-17/h3-5,9,15-16H,6-8,10-14H2,1-2H3