2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(4-propan-2-ylphenyl)guanidine

Systemtic Name: 2-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(4-propan-2-ylphenyl)guanidine Openeye Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(4-isopropylphenyl)guanidine CAS Name: 2-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]-1-(4-propan-2-ylphenyl)guanidine IUPAC Name: 2-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)-1-(4-propan-2-ylphenyl)guanidine Traditional Name: 2-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)-1-p-cumenyl-guanidine Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N=C(N)NC2=CC=C(C=C2)C(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)/N=C(\N)/NC2=CC=C(C=C2)C(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N5O/c1-14(2)17-9-11-18(12-10-17)25-21(23)27-22-24-15(3)19(20(28)26-22)13-16-7-5-4-6-8-16/h4-12,14H,13H2,1-3H3,(H4,23,24,25,26,27,28)