N-[3-(1,3-benzothiazol-2-yl)propyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCCCC4

InChI

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