3-(aminocarbonylamino)-3-(2-methylphenyl)-N-[2-(pyrimidin-2-ylamino)ethyl]propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(2-methylphenyl)-N-[2-(pyrimidin-2-ylamino)ethyl]propanamide Openeye Name: 3-(o-tolyl)-N-[2-(pyrimidin-2-ylamino)ethyl]-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(2-methylphenyl)-N-[2-(2-pyrimidinylamino)ethyl]propanamide IUPAC Name: 3-(carbamoylamino)-3-(2-methylphenyl)-N-[2-(pyrimidin-2-ylamino)ethyl]propanamide Traditional Name: 3-(o-tolyl)-N-[2-(2-pyrimidylamino)ethyl]-3-ureido-propionamide Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)NCCNC2=NC=CC=N2)NC(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)NCCNC2=NC=CC=N2)NC(=O)N

InChI

InChI=1S/C17H22N6O2/c1-12-5-2-3-6-13(12)14(23-16(18)25)11-15(24)19-9-10-22-17-20-7-4-8-21-17/h2-8,14H,9-11H2,1H3,(H,19,24)(H3,18,23,25)(H,20,21,22)