N-(4-methoxyphenyl)-4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazine-1-carboxamide

Systemtic Name: N-(4-methoxyphenyl)-4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazine-1-carboxamide Openeye Name: N-(4-methoxyphenyl)-4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazine-1-carboxamide CAS Name: N-(4-methoxyphenyl)-4-[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-methoxyphenyl)-4-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)piperazine-1-carboxamide Traditional Name: N-(4-methoxyphenyl)-4-(4-methyl-6-pyrrolidino-pyrimidin-2-yl)piperazine-1-carboxamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)OC)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)OC)N4CCCC4

InChI

InChI=1S/C21H28N6O2/c1-16-15-19(25-9-3-4-10-25)24-20(22-16)26-11-13-27(14-12-26)21(28)23-17-5-7-18(29-2)8-6-17/h5-8,15H,3-4,9-14H2,1-2H3,(H,23,28)