[4-[(4-propan-2-ylphenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate

Systemtic Name: [4-[(4-propan-2-ylphenyl)sulfonyl-pyridin-4-ylcarbonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate Openeye Name: [4-[(4-isopropylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]-1-naphthyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[[oxo(pyridin-4-yl)methyl]-(4-propan-2-ylphenyl)sulfonylamino]-1-naphthalenyl] ester IUPAC Name: [4-[(4-propan-2-ylphenyl)sulfonyl-(pyridine-4-carbonyl)amino]naphthalen-1-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[isonicotinoyl(p-cumenylsulfonyl)amino]-1-naphthyl] ester Formula: C31H25N3O5S MolecularWeight: 551.6123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5

InChI

InChI=1S/C31H25N3O5S/c1-21(2)22-7-9-25(10-8-22)40(37,38)34(30(35)23-13-17-32-18-14-23)28-11-12-29(27-6-4-3-5-26(27)28)39-31(36)24-15-19-33-20-16-24/h3-21H,1-2H3