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

Systemtic Name: methyl 4-[[2-[(4-chlorophenyl)carbonylcarbamoylamino]phenyl]amino]-2,5-dihydrothiophene-3-carboxylate Openeye Name: methyl 4-[2-[(4-chlorobenzoyl)carbamoylamino]anilino]-2,5-dihydrothiophene-3-carboxylate CAS Name: 4-[2-[[[[(4-chlorophenyl)-oxomethyl]amino]-oxomethyl]amino]anilino]-2,5-dihydrothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-chlorobenzoyl)carbamoylamino]anilino]-2,5-dihydrothiophene-3-carboxylate Traditional Name: 4-[2-[(4-chlorobenzoyl)carbamoylamino]anilino]-2,5-dihydrothiophene-3-carboxylic acid methyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CSC1)NC2=CC=CC=C2NC(=O)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(CSC1)NC2=CC=CC=C2NC(=O)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3O4S/c1-28-19(26)14-10-29-11-17(14)22-15-4-2-3-5-16(15)23-20(27)24-18(25)12-6-8-13(21)9-7-12/h2-9,22H,10-11H2,1H3,(H2,23,24,25,27)