2-[(6-methyl-2-phenyl-5-prop-2-enyl-pyrimidin-4-yl)-(2-methylprop-2-enyl)amino]-N-(phenylmethyl)octanamide

Systemtic Name: 2-[(6-methyl-2-phenyl-5-prop-2-enyl-pyrimidin-4-yl)-(2-methylprop-2-enyl)amino]-N-(phenylmethyl)octanamide Openeye Name: 2-[(5-allyl-6-methyl-2-phenyl-pyrimidin-4-yl)-(2-methylallyl)amino]-N-benzyl-octanamide CAS Name: 2-[(6-methyl-2-phenyl-5-prop-2-enyl-4-pyrimidinyl)-(2-methylprop-2-enyl)amino]-N-(phenylmethyl)octanamide IUPAC Name: N-benzyl-2-[(6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-yl)-(2-methylprop-2-enyl)amino]octanamide Traditional Name: 2-[(5-allyl-6-methyl-2-phenyl-pyrimidin-4-yl)-(2-methylallyl)amino]-N-benzyl-caprylamide Formula: C33H42N4O MolecularWeight: 510.71278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NCC1=CC=CC=C1)N(CC(=C)C)C2=NC(=NC(=C2CC=C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C(=O)NCC1=CC=CC=C1)N(CC(=C)C)C2=NC(=NC(=C2CC=C)C)C3=CC=CC=C3

InChI

InChI=1S/C33H42N4O/c1-6-8-9-16-22-30(33(38)34-23-27-18-12-10-13-19-27)37(24-25(3)4)32-29(17-7-2)26(5)35-31(36-32)28-20-14-11-15-21-28/h7,10-15,18-21,30H,2-3,6,8-9,16-17,22-24H2,1,4-5H3,(H,34,38)