N-(2-azanylethyl)-4-cyano-N-[1-[4,5-dimethyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]benzamide

Systemtic Name: N-(2-azanylethyl)-4-cyano-N-[1-[4,5-dimethyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]benzamide Openeye Name: N-(2-aminoethyl)-N-[1-(1-benzyl-4,5-dimethyl-6-oxo-pyrimidin-2-yl)-2-methyl-propyl]-4-cyano-benzamide CAS Name: N-(2-aminoethyl)-4-cyano-N-[1-[4,5-dimethyl-6-oxo-1-(phenylmethyl)-2-pyrimidinyl]-2-methylpropyl]benzamide IUPAC Name: N-(2-aminoethyl)-N-[1-(1-benzyl-4,5-dimethyl-6-oxopyrimidin-2-yl)-2-methylpropyl]-4-cyanobenzamide Traditional Name: N-(2-aminoethyl)-N-[1-(1-benzyl-6-keto-4,5-dimethyl-pyrimidin-2-yl)-2-methyl-propyl]-4-cyano-benzamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N(C1=O)CC2=CC=CC=C2)C(C(C)C)N(CCN)C(=O)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(N=C(N(C1=O)CC2=CC=CC=C2)C(C(C)C)N(CCN)C(=O)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C27H31N5O2/c1-18(2)24(31(15-14-28)27(34)23-12-10-21(16-29)11-13-23)25-30-20(4)19(3)26(33)32(25)17-22-8-6-5-7-9-22/h5-13,18,24H,14-15,17,28H2,1-4H3