4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)butanamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)butanamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)butanamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)butyramide Formula: C25H24ClN3O3S2 MolecularWeight: 514.05936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCCS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClN3O3S2/c1-2-18-7-5-9-22-24(18)28-25(33-22)29(17-20-8-3-4-15-27-20)23(30)10-6-16-34(31,32)21-13-11-19(26)12-14-21/h3-5,7-9,11-15H,2,6,10,16-17H2,1H3