4-(4-chlorophenyl)sulfanyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-(4-ethoxy-3-methyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)Cl)N2C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)Cl)N2C

InChI

InChI=1S/C20H21ClN2O2S2/c1-3-25-16-6-4-7-17-19(16)23(2)20(27-17)22-18(24)8-5-13-26-15-11-9-14(21)10-12-15/h4,6-7,9-12H,3,5,8,13H2,1-2H3