N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-4-methyl-2-(4-methylpiperazino)pyrimidine-5-carboxamide Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCC2=C(C=CC(=C2)OC)OC)N3CCN(CC3)C

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCC2=C(C=CC(=C2)OC)OC)N3CCN(CC3)C

InChI

InChI=1S/C20H27N5O3/c1-14-17(13-22-20(23-14)25-9-7-24(2)8-10-25)19(26)21-12-15-11-16(27-3)5-6-18(15)28-4/h5-6,11,13H,7-10,12H2,1-4H3,(H,21,26)