[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(phenylthio)-3-pyridinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[2-(phenylthio)-3-pyridyl]methanone Formula: C24H25N3OS MolecularWeight: 403.5398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)C

InChI

InChI=1S/C24H25N3OS/c1-18-8-6-12-22(19(18)2)26-14-16-27(17-15-26)24(28)21-11-7-13-25-23(21)29-20-9-4-3-5-10-20/h3-13H,14-17H2,1-2H3