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

Systemtic Name: methyl 2-[2-(3,4-dimethylphenyl)carbonylimino-4-methoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(3,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3,4-dimethylphenyl)-oxomethyl]imino-4-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3,4-dimethylbenzoyl)imino-4-methoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O4S/c1-12-8-9-14(10-13(12)2)19(24)21-20-22(11-17(23)26-4)18-15(25-3)6-5-7-16(18)27-20/h5-10H,11H2,1-4H3