ethyl 2-[[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxidanylidene-quinoxalin-6-yl]sulfamoyl]-2-cyclopentyl-ethanoate

Systemtic Name: ethyl 2-[[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxidanylidene-quinoxalin-6-yl]sulfamoyl]-2-cyclopentyl-ethanoate Openeye Name: ethyl 2-[[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxo-quinoxalin-6-yl]sulfamoyl]-2-cyclopentyl-acetate CAS Name: 2-[[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxo-6-quinoxalinyl]sulfamoyl]-2-cyclopentylacetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxoquinoxalin-6-yl]sulfamoyl]-2-cyclopentylacetate Traditional Name: 2-[[3-(4-amidinobenzyl)-2-keto-1-methyl-quinoxalin-6-yl]sulfamoyl]-2-cyclopentyl-acetic acid ethyl ester Formula: C26H31N5O5S MolecularWeight: 525.61984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCC1)S(=O)(=O)NC2=CC3=C(C=C2)N(C(=O)C(=N3)CC4=CC=C(C=C4)C(=N)N)C

Isomeric SMILES

CCOC(=O)C(C1CCCC1)S(=O)(=O)NC2=CC3=C(C=C2)N(C(=O)C(=N3)CC4=CC=C(C=C4)C(=N)N)C

InChI

InChI=1S/C26H31N5O5S/c1-3-36-26(33)23(17-6-4-5-7-17)37(34,35)30-19-12-13-22-20(15-19)29-21(25(32)31(22)2)14-16-8-10-18(11-9-16)24(27)28/h8-13,15,17,23,30H,3-7,14H2,1-2H3,(H3,27,28)