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

Systemtic Name: 4-[4-[[5-tert-butyl-2-(3,5-dimethylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[4-[[5-tert-butyl-2-(3,5-dimethylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-[[[[5-tert-butyl-2-(3,5-dimethylphenyl)-3-pyrazolyl]amino]-oxomethyl]amino]phenyl]thio]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[4-[[5-tert-butyl-2-(3,5-dimethylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-[[5-tert-butyl-2-(3,5-dimethylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]thio]-N-methyl-picolinamide Formula: C29H32N6O2S MolecularWeight: 528.66838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)SC4=CC(=NC=C4)C(=O)NC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)SC4=CC(=NC=C4)C(=O)NC)C

InChI

InChI=1S/C29H32N6O2S/c1-18-13-19(2)15-21(14-18)35-26(17-25(34-35)29(3,4)5)33-28(37)32-20-7-9-22(10-8-20)38-23-11-12-31-24(16-23)27(36)30-6/h7-17H,1-6H3,(H,30,36)(H2,32,33,37)