methyl 2-[7-chloranyl-2-(2,4-dimethylphenyl)carbonylimino-4-methoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[7-chloranyl-2-(2,4-dimethylphenyl)carbonylimino-4-methoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[7-chloro-2-(2,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[7-chloro-2-[(2,4-dimethylphenyl)-oxomethyl]imino-4-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-chloro-2-(2,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[7-chloro-2-(2,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)OC)CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)OC)CC(=O)OC)C

InChI

InChI=1S/C20H19ClN2O4S/c1-11-5-6-13(12(2)9-11)19(25)22-20-23(10-16(24)27-4)17-15(26-3)8-7-14(21)18(17)28-20/h5-9H,10H2,1-4H3