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

Systemtic Name: methyl 4-[2-[2-[(2-methylphenyl)carbonylamino]ethanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[[2-[(2-methylbenzoyl)amino]acetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[2-[[(2-methylphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[[2-[(2-methylbenzoyl)amino]acetyl]amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[[2-(o-toluoylamino)acetyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)OC

InChI

InChI=1S/C19H18N4O4S/c1-11-5-3-4-6-13(11)17(25)21-9-16(24)23-19-22-15(10-28-19)12-7-14(20-8-12)18(26)27-2/h3-8,10,20H,9H2,1-2H3,(H,21,25)(H,22,23,24)