4-butyl-N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-propyl-benzamide

Systemtic Name: 4-butyl-N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-propyl-benzamide Openeye Name: 4-butyl-N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxo-ethyl]-N-propyl-benzamide CAS Name: 4-butyl-N-[2-[(2,5-ditert-butyl-3-pyrazolyl)amino]-2-oxoethyl]-N-propylbenzamide IUPAC Name: 4-butyl-N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-oxoethyl]-N-propylbenzamide Traditional Name: 4-butyl-N-[2-[(2,5-ditert-butylpyrazol-3-yl)amino]-2-keto-ethyl]-N-propyl-benzamide Formula: C27H42N4O2 MolecularWeight: 454.64798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCC)CC(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCC)CC(=O)NC2=CC(=NN2C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H42N4O2/c1-9-11-12-20-13-15-21(16-14-20)25(33)30(17-10-2)19-24(32)28-23-18-22(26(3,4)5)29-31(23)27(6,7)8/h13-16,18H,9-12,17,19H2,1-8H3,(H,28,32)