2-[(4-carbamimidoylphenyl)amino]-2-(7-ethyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-N-sulfamoyl-ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(7-ethyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-N-sulfamoyl-ethanamide Openeye Name: 2-(4-carbamimidoylanilino)-2-(7-ethyl-3,3-dimethyl-2H-benzofuran-5-yl)-N-sulfamoyl-acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-(7-ethyl-3,3-dimethyl-2H-benzofuran-5-yl)-N-sulfamoylacetamide IUPAC Name: 2-(4-carbamimidoylanilino)-2-(7-ethyl-3,3-dimethyl-2H-1-benzofuran-5-yl)-N-sulfamoylacetamide Traditional Name: 2-(4-amidinoanilino)-2-(7-ethyl-3,3-dimethyl-coumaran-5-yl)-N-sulfamoyl-acetamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)C(C(=O)NS(=O)(=O)N)NC3=CC=C(C=C3)C(=N)N)C(CO2)(C)C

Isomeric SMILES

CCC1=C2C(=CC(=C1)C(C(=O)NS(=O)(=O)N)NC3=CC=C(C=C3)C(=N)N)C(CO2)(C)C

InChI

InChI=1S/C21H27N5O4S/c1-4-12-9-14(10-16-18(12)30-11-21(16,2)3)17(20(27)26-31(24,28)29)25-15-7-5-13(6-8-15)19(22)23/h5-10,17,25H,4,11H2,1-3H3,(H3,22,23)(H,26,27)(H2,24,28,29)