methyl 4-[2-[(3,4-diethoxyphenyl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(3,4-diethoxyphenyl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(3,4-diethoxybenzoyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(3,4-diethoxybenzoyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[(3,4-diethoxybenzoyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC)OCC

InChI

InChI=1S/C20H21N3O5S/c1-4-27-16-7-6-12(9-17(16)28-5-2)18(24)23-20-22-15(11-29-20)13-8-14(21-10-13)19(25)26-3/h6-11,21H,4-5H2,1-3H3,(H,22,23,24)