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

Systemtic Name: 4-[4-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[4-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-[[[[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]amino]-oxomethyl]amino]phenyl]thio]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[4-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]carbamoylamino]phenyl]sulfanyl-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]carbamoylamino]phenyl]thio]-N-methyl-picolinamide Formula: C28H30N6O2S MolecularWeight: 514.6418

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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

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

InChI

InChI=1S/C28H30N6O2S/c1-18-7-6-8-20(15-18)34-25(17-24(33-34)28(2,3)4)32-27(36)31-19-9-11-21(12-10-19)37-22-13-14-30-23(16-22)26(35)29-5/h6-17H,1-5H3,(H,29,35)(H2,31,32,36)