4-[4-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[4-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[4-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-[[[[5-tert-butyl-2-(4-chlorophenyl)-3-pyrazolyl]amino]-oxomethyl]amino]phenyl]thio]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[4-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]carbamoylamino]phenyl]thio]-N-methyl-picolinamide Formula: C27H27ClN6O2S MolecularWeight: 535.06028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)SC3=CC(=NC=C3)C(=O)NC)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)SC3=CC(=NC=C3)C(=O)NC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H27ClN6O2S/c1-27(2,3)23-16-24(34(33-23)19-9-5-17(28)6-10-19)32-26(36)31-18-7-11-20(12-8-18)37-21-13-14-30-22(15-21)25(35)29-4/h5-16H,1-4H3,(H,29,35)(H2,31,32,36)