N-[(2,4-dimethylphenyl)carbamoyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3)C

InChI

InChI=1S/C20H26N6O2/c1-14-5-6-17(15(2)13-14)23-20(28)24-18(27)16(3)25-9-11-26(12-10-25)19-21-7-4-8-22-19/h4-8,13,16H,9-12H2,1-3H3,(H2,23,24,27,28)