N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C18H18ClN3O3S3 MolecularWeight: 456.00182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C18H18ClN3O3S3/c1-11-12(19)7-8-14-16(11)20-18(27-14)21-17(23)13-5-2-3-9-22(13)28(24,25)15-6-4-10-26-15/h4,6-8,10,13H,2-3,5,9H2,1H3,(H,20,21,23)