3-[[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide

Systemtic Name: 3-[[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide Openeye Name: 3-[[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide CAS Name: 3-[[1-[3-(4-carbamimidoylphenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide IUPAC Name: 3-[[1-[3-(4-carbamimidoylphenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide Traditional Name: 3-[[1-[3-(4-amidinophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]sulfamoyl]benzamide Formula: C26H27N5O4S MolecularWeight: 505.58868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)N)N(C1)C(=O)CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)N)N(C1)C(=O)CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C26H27N5O4S/c27-25(28)18-9-6-17(7-10-18)8-13-24(32)31-14-2-4-19-15-21(11-12-23(19)31)30-36(34,35)22-5-1-3-20(16-22)26(29)33/h1,3,5-7,9-12,15-16,30H,2,4,8,13-14H2,(H3,27,28)(H2,29,33)