2,2-dimethyl-1-[4-[2-methyl-6-[(4-methylphenyl)amino]pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-[2-methyl-6-[(4-methylphenyl)amino]pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[4-[2-methyl-6-(4-methylanilino)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[4-[2-methyl-6-(p-toluidino)pyrimidin-4-yl]piperazino]propan-1-one Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3CCN(CC3)C(=O)C(C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3CCN(CC3)C(=O)C(C)(C)C)C

InChI

InChI=1S/C21H29N5O/c1-15-6-8-17(9-7-15)24-18-14-19(23-16(2)22-18)25-10-12-26(13-11-25)20(27)21(3,4)5/h6-9,14H,10-13H2,1-5H3,(H,22,23,24)