[2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-[[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-[[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]methyl]thiazol-4-yl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C25H25ClN6O2S2 MolecularWeight: 541.088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC(=CC=C2)Cl)SCC3=NC(=CS3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NN=C(N1C2=CC(=CC=C2)Cl)SCC3=NC(=CS3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C25H25ClN6O2S2/c1-17-28-29-25(32(17)20-5-3-4-18(26)14-20)36-16-23-27-22(15-35-23)24(33)31-12-10-30(11-13-31)19-6-8-21(34-2)9-7-19/h3-9,14-15H,10-13,16H2,1-2H3