methyl 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoate

Systemtic Name: methyl 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoate Openeye Name: methyl 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoate CAS Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoate Traditional Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid methyl ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H18N2O3S/c1-24-15-8-9-16-13(11-15)5-10-17-18(16)22-20(26-17)21-14-6-3-12(4-7-14)19(23)25-2/h3-4,6-9,11H,5,10H2,1-2H3,(H,21,22)