2-[1-[2-(3-azanyl-1,2-benzoxazol-5-yl)-5-methyl-pyrazol-3-yl]carbonyl-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide

Systemtic Name: 2-[1-[2-(3-azanyl-1,2-benzoxazol-5-yl)-5-methyl-pyrazol-3-yl]carbonyl-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Openeye Name: 2-[1-[2-(3-amino-1,2-benzoxazol-5-yl)-5-methyl-pyrazole-3-carbonyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide CAS Name: 2-[1-[[2-(3-amino-1,2-benzoxazol-5-yl)-5-methyl-3-pyrazolyl]-oxomethyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide IUPAC Name: 2-[1-[2-(3-amino-1,2-benzoxazol-5-yl)-5-methylpyrazole-3-carbonyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Traditional Name: 2-[1-[2-(3-aminoindoxazen-5-yl)-5-methyl-pyrazole-3-carbonyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide Formula: C27H24N6O4S MolecularWeight: 528.58226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N2CCCC3=C2C=CC(=C3)C4=CC=CC=C4S(=O)(=O)N)C5=CC6=C(C=C5)ON=C6N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N2CCCC3=C2C=CC(=C3)C4=CC=CC=C4S(=O)(=O)N)C5=CC6=C(C=C5)ON=C6N

InChI

InChI=1S/C27H24N6O4S/c1-16-13-23(33(30-16)19-9-11-24-21(15-19)26(28)31-37-24)27(34)32-12-4-5-18-14-17(8-10-22(18)32)20-6-2-3-7-25(20)38(29,35)36/h2-3,6-11,13-15H,4-5,12H2,1H3,(H2,28,31)(H2,29,35,36)