2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-(5-oxidanylidene-3-pyrrolidin-1-yl-4H-pyrazol-1-yl)phenyl]butanamide hydrochloride

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-(5-oxidanylidene-3-pyrrolidin-1-yl-4H-pyrazol-1-yl)phenyl]butanamide hydrochloride Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[4-(5-oxo-3-pyrrolidin-1-yl-4H-pyrazol-1-yl)phenyl]butanamide hydrochloride CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-3-(1-pyrrolidinyl)-4H-pyrazol-1-yl]phenyl]butanamide hydrochloride IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-(5-oxo-3-pyrrolidin-1-yl-4H-pyrazol-1-yl)phenyl]butanamide hydrochloride Traditional Name: 2-(2,4-ditert-amylphenoxy)-N-[4-(5-keto-3-pyrrolidino-2-pyrazolin-1-yl)phenyl]butyramide hydrochloride Formula: C33H47ClN4O3 MolecularWeight: 583.20428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)CC(=N2)N3CCCC3)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC.Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)CC(=N2)N3CCCC3)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC.Cl

InChI

InChI=1S/C33H46N4O3.ClH/c1-8-27(40-28-18-13-23(32(4,5)9-2)21-26(28)33(6,7)10-3)31(39)34-24-14-16-25(17-15-24)37-30(38)22-29(35-37)36-19-11-12-20-36;/h13-18,21,27H,8-12,19-20,22H2,1-7H3,(H,34,39);1H