N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[5-[[cyclopropyl(oxo)methyl]amino]-2-methylphenyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-3-(2-pyrimidylamino)benzamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C22H21N5O2/c1-14-6-9-18(25-20(28)15-7-8-15)13-19(14)27-21(29)16-4-2-5-17(12-16)26-22-23-10-3-11-24-22/h2-6,9-13,15H,7-8H2,1H3,(H,25,28)(H,27,29)(H,23,24,26)