5-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyrimidine-4-carboxamide

Systemtic Name: 5-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyrimidine-4-carboxamide Openeye Name: 5-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethyl-pyrimidine-4-carboxamide CAS Name: 5-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propylamino]-N,N-dimethyl-4-pyrimidinecarboxamide IUPAC Name: 5-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N,N-dimethylpyrimidine-4-carboxamide Traditional Name: 5-[3-[4-(2-methoxyphenyl)piperazino]propylamino]-N,N-dimethyl-pyrimidine-4-carboxamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=NC=NC=C1NCCCN2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CN(C)C(=O)C1=NC=NC=C1NCCCN2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H30N6O2/c1-25(2)21(28)20-17(15-22-16-24-20)23-9-6-10-26-11-13-27(14-12-26)18-7-4-5-8-19(18)29-3/h4-5,7-8,15-16,23H,6,9-14H2,1-3H3