1-[5-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylpyridin-3-yl]-3-(3-chloranyl-4-methyl-phenyl)urea

Systemtic Name: 1-[5-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylpyridin-3-yl]-3-(3-chloranyl-4-methyl-phenyl)urea Openeye Name: 1-[5-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridyl]-3-(3-chloro-4-methyl-phenyl)urea CAS Name: 1-[5-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]-3-pyridinyl]-3-(3-chloro-4-methylphenyl)urea IUPAC Name: 1-[5-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)pyridin-3-yl]-3-(3-chloro-4-methylphenyl)urea Traditional Name: 1-[5-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridyl]-3-(3-chloro-4-methyl-phenyl)urea Formula: C23H22ClN7O2 MolecularWeight: 463.91948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CN=CC(=C2)C(=O)C3=CN(C4=C3C(=NC=N4)N)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CN=CC(=C2)C(=O)C3=CN(C4=C3C(=NC=N4)N)C(C)C)Cl

InChI

InChI=1S/C23H22ClN7O2/c1-12(2)31-10-17(19-21(25)27-11-28-22(19)31)20(32)14-6-16(9-26-8-14)30-23(33)29-15-5-4-13(3)18(24)7-15/h4-12H,1-3H3,(H2,25,27,28)(H2,29,30,33)