2-[1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperazin-1-yl]pyridin-3-yl]-1,2,4-triazol-3-one

Systemtic Name: 2-[1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperazin-1-yl]pyridin-3-yl]-1,2,4-triazol-3-one Openeye Name: 2-[1-(4-chlorobenzoyl)propyl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperazin-1-yl]-3-pyridyl]-1,2,4-triazol-3-one CAS Name: 2-[1-(4-chlorophenyl)-1-oxobutan-2-yl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]-3-pyridinyl]-1,2,4-triazol-3-one IUPAC Name: 2-[1-(4-chlorophenyl)-1-oxobutan-2-yl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperazin-1-yl]pyridin-3-yl]-1,2,4-triazol-3-one Traditional Name: 2-[1-(4-chlorobenzoyl)propyl]-4-[6-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperazino]-3-pyridyl]-1,2,4-triazol-3-one Formula: C24H25ClN8O2S MolecularWeight: 525.0257

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=C(C=C1)Cl)N2C(=O)N(C=N2)C3=CN=C(C=C3)N4CCN(CC4)C5=NN=C(S5)C

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)Cl)N2C(=O)N(C=N2)C3=CN=C(C=C3)N4CCN(CC4)C5=NN=C(S5)C

InChI

InChI=1S/C24H25ClN8O2S/c1-3-20(22(34)17-4-6-18(25)7-5-17)33-24(35)32(15-27-33)19-8-9-21(26-14-19)30-10-12-31(13-11-30)23-29-28-16(2)36-23/h4-9,14-15,20H,3,10-13H2,1-2H3