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

Systemtic Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[4-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(5,6-dimethyl-1,3-benzothiazol-2-yl)piperazino]-(4-piperidinosulfonylphenyl)methanone Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C25H30N4O3S2/c1-18-16-22-23(17-19(18)2)33-25(26-22)28-14-12-27(13-15-28)24(30)20-6-8-21(9-7-20)34(31,32)29-10-4-3-5-11-29/h6-9,16-17H,3-5,10-15H2,1-2H3