2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=CC(=C1)OC)OC)SC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H17ClN2O3S2/c1-10(25-18-21-15-6-11(19)4-5-16(15)26-18)17(22)20-12-7-13(23-2)9-14(8-12)24-3/h4-10H,1-3H3,(H,20,22)