methyl 4-[[methylsulfonyl(phenyl)carbamoyl]carbamoylamino]-2,3-dihydrothiophene-5-carboxylate

Systemtic Name: methyl 4-[[methylsulfonyl(phenyl)carbamoyl]carbamoylamino]-2,3-dihydrothiophene-5-carboxylate Openeye Name: methyl 4-[[methylsulfonyl(phenyl)carbamoyl]carbamoylamino]-2,3-dihydrothiophene-5-carboxylate CAS Name: 4-[[[[(N-methylsulfonylanilino)-oxomethyl]amino]-oxomethyl]amino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[[methylsulfonyl(phenyl)carbamoyl]carbamoylamino]-2,3-dihydrothiophene-5-carboxylate Traditional Name: 4-[[mesyl(phenyl)carbamoyl]carbamoylamino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester Formula: C15H17N3O6S2 MolecularWeight: 399.44198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CCS1)NC(=O)NC(=O)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=C(CCS1)NC(=O)NC(=O)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H17N3O6S2/c1-24-13(19)12-11(8-9-25-12)16-14(20)17-15(21)18(26(2,22)23)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H2,16,17,20,21)