4-[[5-chloranyl-4-[[2-(cyclopropylcarbonylamino)phenyl]amino]pyrimidin-2-yl]amino]-N-methyl-benzamide

Systemtic Name: 4-[[5-chloranyl-4-[[2-(cyclopropylcarbonylamino)phenyl]amino]pyrimidin-2-yl]amino]-N-methyl-benzamide Openeye Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-methyl-benzamide CAS Name: 4-[[5-chloro-4-[2-[[cyclopropyl(oxo)methyl]amino]anilino]-2-pyrimidinyl]amino]-N-methylbenzamide IUPAC Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-methylbenzamide Traditional Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-methyl-benzamide Formula: C22H21ClN6O2 MolecularWeight: 436.89414

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3NC(=O)C4CC4)Cl

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3NC(=O)C4CC4)Cl

InChI

InChI=1S/C22H21ClN6O2/c1-24-20(30)13-8-10-15(11-9-13)26-22-25-12-16(23)19(29-22)27-17-4-2-3-5-18(17)28-21(31)14-6-7-14/h2-5,8-12,14H,6-7H2,1H3,(H,24,30)(H,28,31)(H2,25,26,27,29)