ethyl 4-[2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-[[(3-methylanilino)-oxomethyl]amino]-4-thiazolyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C22H22N4O4S/c1-3-30-20(28)15-7-9-16(10-8-15)23-19(27)12-18-13-31-22(25-18)26-21(29)24-17-6-4-5-14(2)11-17/h4-11,13H,3,12H2,1-2H3,(H,23,27)(H2,24,25,26,29)