methyl 2-[2-(4-dimethylaminophenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(4-dimethylaminophenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[4-(dimethylamino)benzoyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(4-dimethylaminophenyl)-oxomethyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(dimethylamino)benzoyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[4-(dimethylamino)benzoyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC=C(C=C3)N(C)C)N2CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=CC=C(C=C3)N(C)C)N2CC(=O)OC)C

InChI

InChI=1S/C21H23N3O3S/c1-13-10-14(2)19-17(11-13)28-21(24(19)12-18(25)27-5)22-20(26)15-6-8-16(9-7-15)23(3)4/h6-11H,12H2,1-5H3