4-(4-chlorophenyl)sulfanyl-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)butyramide Formula: C21H23ClN2O3S2 MolecularWeight: 451.00192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)Cl)OC)OC

Isomeric SMILES

CCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)Cl)OC)OC

InChI

InChI=1S/C21H23ClN2O3S2/c1-4-24-16-12-17(26-2)18(27-3)13-19(16)29-21(24)23-20(25)6-5-11-28-15-9-7-14(22)8-10-15/h7-10,12-13H,4-6,11H2,1-3H3