4-[3-azanyl-2-[6-[2-(4-tert-butylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanoylamino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-[3-azanyl-2-[6-[2-(4-tert-butylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanoylamino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-[3-amino-2-[6-[2-(4-tert-butylphenyl)-5-(2-pyridyl)pyrazol-3-yl]hexanoylamino]-3-oxo-propyl]benzamide CAS Name: 4-[3-amino-2-[[6-[2-(4-tert-butylphenyl)-5-(2-pyridinyl)-3-pyrazolyl]-1-oxohexyl]amino]-3-oxopropyl]benzamide IUPAC Name: 4-[3-amino-2-[6-[2-(4-tert-butylphenyl)-5-pyridin-2-ylpyrazol-3-yl]hexanoylamino]-3-oxopropyl]benzamide Traditional Name: 4-[3-amino-2-[6-[2-(4-tert-butylphenyl)-5-(2-pyridyl)pyrazol-3-yl]hexanoylamino]-3-keto-propyl]benzamide Formula: C34H40N6O3 MolecularWeight: 580.7198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=N3)CCCCCC(=O)NC(CC4=CC=C(C=C4)C(=O)N)C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=N3)CCCCCC(=O)NC(CC4=CC=C(C=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C34H40N6O3/c1-34(2,3)25-16-18-26(19-17-25)40-27(22-29(39-40)28-10-7-8-20-37-28)9-5-4-6-11-31(41)38-30(33(36)43)21-23-12-14-24(15-13-23)32(35)42/h7-8,10,12-20,22,30H,4-6,9,11,21H2,1-3H3,(H2,35,42)(H2,36,43)(H,38,41)