ethyl 2-[[2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-quinolin-7-yl]-quinolin-8-ylsulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[[2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-quinolin-7-yl]-quinolin-8-ylsulfonyl-amino]ethanoate Openeye Name: ethyl 2-[[2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-7-quinolyl]-(8-quinolylsulfonyl)amino]acetate CAS Name: 2-[[2-[2-(4-carbamimidoylphenyl)ethyl]-4-methyl-7-quinolinyl]-(8-quinolinylsulfonyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(4-carbamimidoylphenyl)ethyl]-4-methylquinolin-7-yl]-quinolin-8-ylsulfonylamino]acetate Traditional Name: 2-[[2-[2-(4-amidinophenyl)ethyl]-4-methyl-7-quinolyl]-(8-quinolylsulfonyl)amino]acetic acid ethyl ester Formula: C32H31N5O4S MolecularWeight: 581.68464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC2=C(C=C1)C(=CC(=N2)CCC3=CC=C(C=C3)C(=N)N)C)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCOC(=O)CN(C1=CC2=C(C=C1)C(=CC(=N2)CCC3=CC=C(C=C3)C(=N)N)C)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C32H31N5O4S/c1-3-41-30(38)20-37(42(39,40)29-8-4-6-23-7-5-17-35-31(23)29)26-15-16-27-21(2)18-25(36-28(27)19-26)14-11-22-9-12-24(13-10-22)32(33)34/h4-10,12-13,15-19H,3,11,14,20H2,1-2H3,(H3,33,34)