[4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfanylphenyl)methanone

Systemtic Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfanylphenyl)methanone Openeye Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-isopropylsulfanylphenyl)methanone CAS Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[3-(propan-2-ylthio)phenyl]methanone IUPAC Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfanylphenyl)methanone Traditional Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazino]-[3-(isopropylthio)phenyl]methanone Formula: C23H27N3OS2 MolecularWeight: 425.60998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)SC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)SC(C)C

InChI

InChI=1S/C23H27N3OS2/c1-15(2)28-19-7-5-6-18(14-19)22(27)25-8-10-26(11-9-25)23-24-20-12-16(3)17(4)13-21(20)29-23/h5-7,12-15H,8-11H2,1-4H3