methyl 4-[[2-[(4-methoxyphenyl)carbonylcarbamoylamino]phenyl]amino]-2,5-dihydrothiophene-3-carboxylate

Systemtic Name: methyl 4-[[2-[(4-methoxyphenyl)carbonylcarbamoylamino]phenyl]amino]-2,5-dihydrothiophene-3-carboxylate Openeye Name: methyl 4-[2-[(4-methoxybenzoyl)carbamoylamino]anilino]-2,5-dihydrothiophene-3-carboxylate CAS Name: 4-[2-[[[[(4-methoxyphenyl)-oxomethyl]amino]-oxomethyl]amino]anilino]-2,5-dihydrothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-methoxybenzoyl)carbamoylamino]anilino]-2,5-dihydrothiophene-3-carboxylate Traditional Name: 4-[2-(p-anisoylcarbamoylamino)anilino]-2,5-dihydrothiophene-3-carboxylic acid methyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)NC2=CC=CC=C2NC3=C(CSC3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)NC2=CC=CC=C2NC3=C(CSC3)C(=O)OC

InChI

InChI=1S/C21H21N3O5S/c1-28-14-9-7-13(8-10-14)19(25)24-21(27)23-17-6-4-3-5-16(17)22-18-12-30-11-15(18)20(26)29-2/h3-10,22H,11-12H2,1-2H3,(H2,23,24,25,27)