3-bromanyl-N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)benzamide

Systemtic Name: 3-bromanyl-N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)benzamide Openeye Name: 3-bromo-N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-(3-methoxypropyl)benzamide CAS Name: 3-bromo-N-[2-[[5-tert-butyl-2-(3-methylphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)benzamide IUPAC Name: 3-bromo-N-[2-[[5-tert-butyl-2-(3-methylphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-(3-methoxypropyl)benzamide Traditional Name: 3-bromo-N-[2-[[5-tert-butyl-2-(m-tolyl)pyrazol-3-yl]amino]-2-keto-ethyl]-N-(3-methoxypropyl)benzamide Formula: C27H33BrN4O3 MolecularWeight: 541.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCCOC)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCCOC)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C27H33BrN4O3/c1-19-9-6-12-22(15-19)32-24(17-23(30-32)27(2,3)4)29-25(33)18-31(13-8-14-35-5)26(34)20-10-7-11-21(28)16-20/h6-7,9-12,15-17H,8,13-14,18H2,1-5H3,(H,29,33)