2-[[4-[(5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]phenyl]carbamoyl]benzenesulfonic acid

Systemtic Name: 2-[[4-[(5,7-diethyl-2-oxidanylidene-1,6-naphthyridin-1-yl)methyl]phenyl]carbamoyl]benzenesulfonic acid Openeye Name: 2-[[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]phenyl]carbamoyl]benzenesulfonic acid CAS Name: 2-[[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]anilino]-oxomethyl]benzenesulfonic acid IUPAC Name: 2-[[4-[(5,7-diethyl-2-oxo-1,6-naphthyridin-1-yl)methyl]phenyl]carbamoyl]benzenesulfonic acid Traditional Name: 2-[[4-[(5,7-diethyl-2-keto-1,6-naphthyridin-1-yl)methyl]phenyl]carbamoyl]besylic acid Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C=CC(=O)N(C2=C1)CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)O)CC

Isomeric SMILES

CCC1=NC(=C2C=CC(=O)N(C2=C1)CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)O)CC

InChI

InChI=1S/C26H25N3O5S/c1-3-18-15-23-20(22(4-2)27-18)13-14-25(30)29(23)16-17-9-11-19(12-10-17)28-26(31)21-7-5-6-8-24(21)35(32,33)34/h5-15H,3-4,16H2,1-2H3,(H,28,31)(H,32,33,34)