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

Systemtic Name: 4-[[5-chloranyl-4-[[2-(cyclopropylcarbonylamino)phenyl]amino]pyrimidin-2-yl]amino]-N-cyclobutyl-benzamide Openeye Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-cyclobutyl-benzamide CAS Name: 4-[[5-chloro-4-[2-[[cyclopropyl(oxo)methyl]amino]anilino]-2-pyrimidinyl]amino]-N-cyclobutylbenzamide IUPAC Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-cyclobutylbenzamide Traditional Name: 4-[[5-chloro-4-[2-(cyclopropanecarbonylamino)anilino]pyrimidin-2-yl]amino]-N-cyclobutyl-benzamide Formula: C25H25ClN6O2 MolecularWeight: 476.958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4NC(=O)C5CC5)Cl

Isomeric SMILES

C1CC(C1)NC(=O)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4NC(=O)C5CC5)Cl

InChI

InChI=1S/C25H25ClN6O2/c26-19-14-27-25(29-18-12-10-16(11-13-18)23(33)28-17-4-3-5-17)32-22(19)30-20-6-1-2-7-21(20)31-24(34)15-8-9-15/h1-2,6-7,10-15,17H,3-5,8-9H2,(H,28,33)(H,31,34)(H2,27,29,30,32)