1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(5,7-dimethyl-3-propargyl-1,3-benzothiazol-2-ylidene)pipecolinamide Formula: C22H22ClN3O3S3 MolecularWeight: 508.07638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(C(=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(S4)Cl)S2)CC#C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(C(=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(S4)Cl)S2)CC#C)C

InChI

InChI=1S/C22H22ClN3O3S3/c1-4-10-25-17-13-14(2)12-15(3)20(17)31-22(25)24-21(27)16-7-5-6-11-26(16)32(28,29)19-9-8-18(23)30-19/h1,8-9,12-13,16H,5-7,10-11H2,2-3H3