methyl 2-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzoate Openeye Name: methyl 2-[3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]propanoylamino]benzoate CAS Name: 2-[[3-[2-[[(4-methoxyanilino)-oxomethyl]amino]-4-thiazolyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzoate Traditional Name: 2-[3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]propanoylamino]benzoic acid methyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H22N4O5S/c1-30-16-10-7-14(8-11-16)23-21(29)26-22-24-15(13-32-22)9-12-19(27)25-18-6-4-3-5-17(18)20(28)31-2/h3-8,10-11,13H,9,12H2,1-2H3,(H,25,27)(H2,23,24,26,29)