N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-benzyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(1-piperidylsulfonyl)benzamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-benzyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-benzyl-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-piperidinosulfonyl-benzamide Formula: C28H29N3O3S2 MolecularWeight: 519.67816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C28H29N3O3S2/c1-20-11-12-21(2)26-25(20)29-28(35-26)31(19-22-9-5-3-6-10-22)27(32)23-13-15-24(16-14-23)36(33,34)30-17-7-4-8-18-30/h3,5-6,9-16H,4,7-8,17-19H2,1-2H3