ethyl 2-[[(4-methylphenyl)carbamoylamino]-(phenylcarbamoyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-methylphenyl)carbamoylamino]-(phenylcarbamoyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[phenylcarbamoyl-(p-tolylcarbamoylamino)amino]thiazole-4-carboxylate CAS Name: 2-[[anilino(oxo)methyl]-[[(4-methylanilino)-oxomethyl]amino]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-methylphenyl)carbamoylamino]-(phenylcarbamoyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[phenylcarbamoyl-(p-tolylcarbamoylamino)amino]thiazole-4-carboxylic acid ethyl ester Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)N(C(=O)NC2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)N(C(=O)NC2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H21N5O4S/c1-3-30-18(27)17-13-31-21(24-17)26(20(29)23-15-7-5-4-6-8-15)25-19(28)22-16-11-9-14(2)10-12-16/h4-13H,3H2,1-2H3,(H,23,29)(H2,22,25,28)