dimethyl 5-[(2-azanyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(2-azanyl-4-phenyl-1,3-thiazol-5-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-amino-4-phenyl-thiazole-5-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(2-amino-4-phenyl-5-thiazolyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-amino-4-phenyl-1,3-thiazole-5-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-amino-4-phenyl-thiazole-5-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=C(S2)N)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=C(S2)N)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H17N3O5S/c1-27-18(25)12-8-13(19(26)28-2)10-14(9-12)22-17(24)16-15(23-20(21)29-16)11-6-4-3-5-7-11/h3-10H,1-2H3,(H2,21,23)(H,22,24)