N-(3-azanylpropyl)-N-[1-[4-cyano-5-methyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]-4-ethyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[4-cyano-5-methyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]-2-methyl-propyl]-4-ethyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(1-benzyl-4-cyano-5-methyl-6-oxo-pyrimidin-2-yl)-2-methyl-propyl]-4-ethyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[4-cyano-5-methyl-6-oxo-1-(phenylmethyl)-2-pyrimidinyl]-2-methylpropyl]-4-ethylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(1-benzyl-4-cyano-5-methyl-6-oxopyrimidin-2-yl)-2-methylpropyl]-4-ethylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(1-benzyl-4-cyano-6-keto-5-methyl-pyrimidin-2-yl)-2-methyl-propyl]-4-ethyl-benzamide Formula: C29H35N5O2 MolecularWeight: 485.6205

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C)C#N)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC(=C(C(=O)N2CC3=CC=CC=C3)C)C#N)C(C)C

InChI

InChI=1S/C29H35N5O2/c1-5-22-12-14-24(15-13-22)29(36)33(17-9-16-30)26(20(2)3)27-32-25(18-31)21(4)28(35)34(27)19-23-10-7-6-8-11-23/h6-8,10-15,20,26H,5,9,16-17,19,30H2,1-4H3