4-(1,3-benzothiazol-2-yl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)butyramide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H27N3O3S2/c1-17-12-13-18(16-21(17)31(28,29)26-14-5-2-6-15-26)24-22(27)10-7-11-23-25-19-8-3-4-9-20(19)30-23/h3-4,8-9,12-13,16H,2,5-7,10-11,14-15H2,1H3,(H,24,27)