methyl 3-[[4-[(3-carbamimidoylphenyl)carbamoylamino]phenyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[(3-carbamimidoylphenyl)carbamoylamino]phenyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-[(3-carbamimidoylphenyl)carbamoylamino]phenyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[4-[[(3-carbamimidoylanilino)-oxomethyl]amino]phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[(3-carbamimidoylphenyl)carbamoylamino]phenyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[4-[(3-amidinophenyl)carbamoylamino]phenyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C20H19N5O5S2 MolecularWeight: 473.52536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=C(C=C2)NC(=O)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=C(C=C2)NC(=O)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C20H19N5O5S2/c1-30-19(26)17-16(9-10-31-17)32(28,29)25-14-7-5-13(6-8-14)23-20(27)24-15-4-2-3-12(11-15)18(21)22/h2-11,25H,1H3,(H3,21,22)(H2,23,24,27)