N-(7-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)pipecolinamide Formula: C19H20ClN3O3S3 MolecularWeight: 470.0284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)N2C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CS4)N2C

InChI

InChI=1S/C19H20ClN3O3S3/c1-12-8-9-13(20)17-16(12)22(2)19(28-17)21-18(24)14-6-3-4-10-23(14)29(25,26)15-7-5-11-27-15/h5,7-9,11,14H,3-4,6,10H2,1-2H3