[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-piperidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[4-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazino]-(4-piperidinosulfonylphenyl)methanone Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

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