N-(1,3-benzothiazol-2-ylmethyl)-4-chloranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-3-piperidinosulfonyl-benzamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H20ClN3O3S2/c21-15-9-8-14(12-18(15)29(26,27)24-10-4-1-5-11-24)20(25)22-13-19-23-16-6-2-3-7-17(16)28-19/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,22,25)