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

Systemtic Name: 1-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-3-(2-methoxy-5-methyl-phenyl)urea Openeye Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-methoxy-5-methyl-phenyl)urea CAS Name: 1-[3-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]phenyl]-3-(2-methoxy-5-methylphenyl)urea IUPAC Name: 1-[3-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-methoxy-5-methylphenyl)urea Traditional Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-methoxy-5-methyl-phenyl)urea Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N6O3/c1-14(2)31-12-18(21-23(26)27-13-28-24(21)31)22(32)16-6-5-7-17(11-16)29-25(33)30-19-10-15(3)8-9-20(19)34-4/h5-14H,1-4H3,(H2,26,27,28)(H2,29,30,33)