N-(1,3-benzothiazol-2-yl)-2-methoxy-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-methoxy-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-methoxy-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-methoxy-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-methoxy-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-methoxy-5-piperidinosulfonyl-benzamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3O4S2/c1-27-17-10-9-14(29(25,26)23-11-5-2-6-12-23)13-15(17)19(24)22-20-21-16-7-3-4-8-18(16)28-20/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,21,22,24)