N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C22H30N6O2/c1-4-18-8-5-6-9-19(18)25-20(29)16-26(3)21(30)17(2)27-12-14-28(15-13-27)22-23-10-7-11-24-22/h5-11,17H,4,12-16H2,1-3H3,(H,25,29)