ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]-1,2,3-thiadiazol-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]-1,2,3-thiadiazol-4-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[5-(p-tolylcarbamoylamino)thiadiazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[5-[[(4-methylanilino)-oxomethyl]amino]-4-thiadiazolyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-[(4-methylphenyl)carbamoylamino]thiadiazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[5-(p-tolylcarbamoylamino)thiadiazole-4-carbonyl]amino]benzoic acid ethyl ester Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(SN=N2)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(SN=N2)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H19N5O4S/c1-3-29-19(27)13-6-10-14(11-7-13)21-17(26)16-18(30-25-24-16)23-20(28)22-15-8-4-12(2)5-9-15/h4-11H,3H2,1-2H3,(H,21,26)(H2,22,23,28)