methyl 2-[2-(4-dimethylaminophenyl)carbonyliminobenzo[g][1,3]benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(4-dimethylaminophenyl)carbonyliminobenzo[g][1,3]benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[4-(dimethylamino)benzoyl]iminobenzo[g][1,3]benzothiazol-3-yl]acetate CAS Name: 2-[2-[(4-dimethylaminophenyl)-oxomethyl]imino-3-benzo[g][1,3]benzothiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(dimethylamino)benzoyl]iminobenzo[g][1,3]benzothiazol-3-yl]acetate Traditional Name: 2-[2-[4-(dimethylamino)benzoyl]iminobenzo[g][1,3]benzothiazol-3-yl]acetic acid methyl ester Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C4=CC=CC=C4C=C3)CC(=O)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C4=CC=CC=C4C=C3)CC(=O)OC

InChI

InChI=1S/C23H21N3O3S/c1-25(2)17-11-8-16(9-12-17)22(28)24-23-26(14-20(27)29-3)19-13-10-15-6-4-5-7-18(15)21(19)30-23/h4-13H,14H2,1-3H3