N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide

Systemtic Name: N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide Openeye Name: N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-oxo-ethyl]-4-hexyl-benzamide CAS Name: N-butyl-N-[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)amino]-2-oxoethyl]-4-hexylbenzamide IUPAC Name: N-butyl-N-[2-[(5-tert-butyl-2-methylpyrazol-3-yl)amino]-2-oxoethyl]-4-hexylbenzamide Traditional Name: N-butyl-N-[2-[(5-tert-butyl-2-methyl-pyrazol-3-yl)amino]-2-keto-ethyl]-4-hexyl-benzamide Formula: C27H42N4O2 MolecularWeight: 454.64798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)NC2=CC(=NN2C)C(C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)NC2=CC(=NN2C)C(C)(C)C

InChI

InChI=1S/C27H42N4O2/c1-7-9-11-12-13-21-14-16-22(17-15-21)26(33)31(18-10-8-2)20-25(32)28-24-19-23(27(3,4)5)29-30(24)6/h14-17,19H,7-13,18,20H2,1-6H3,(H,28,32)