4-[3-[[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbonylamino]carbamoyl]-5-pyridin-2-yl-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbonylamino]carbamoyl]-5-pyridin-2-yl-pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[[[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoyl]amino]carbamoyl]-5-(2-pyridyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[3-[[[[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-oxomethyl]hydrazo]-oxomethyl]-5-(2-pyridinyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[3-[[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoyl]amino]carbamoyl]-5-pyridin-2-ylpyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[[[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoyl]amino]carbamoyl]-5-(2-pyridyl)pyrazol-1-yl]benzenesulfonamide Formula: C32H26N10O4S MolecularWeight: 646.67844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=NN(C(=C2)C3=CC=CC=N3)C4=CC=C(C=C4)S(=O)(=O)N)NC5=NC=CC(=N5)C6=CN=CC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=O)C2=NN(C(=C2)C3=CC=CC=N3)C4=CC=C(C=C4)S(=O)(=O)N)NC5=NC=CC(=N5)C6=CN=CC=C6

InChI

InChI=1S/C32H26N10O4S/c1-20-7-8-21(17-27(20)38-32-36-16-13-25(37-32)22-5-4-14-34-19-22)30(43)39-40-31(44)28-18-29(26-6-2-3-15-35-26)42(41-28)23-9-11-24(12-10-23)47(33,45)46/h2-19H,1H3,(H,39,43)(H,40,44)(H2,33,45,46)(H,36,37,38)