5-(1,3-benzothiazol-2-yl)-N-(4-chloranyl-2,5-dimethoxy-phenyl)pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-(4-chloranyl-2,5-dimethoxy-phenyl)pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-(4-chloro-2,5-dimethoxy-phenyl)pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-(4-chloro-2,5-dimethoxyphenyl)pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-(4-chloro-2,5-dimethoxyphenyl)pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-(4-chloro-2,5-dimethoxy-phenyl)valeramide Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCCCC2=NC3=CC=CC=C3S2)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCCCC2=NC3=CC=CC=C3S2)OC)Cl

InChI

InChI=1S/C20H21ClN2O3S/c1-25-16-12-15(17(26-2)11-13(16)21)22-19(24)9-5-6-10-20-23-14-7-3-4-8-18(14)27-20/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H,22,24)