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

Systemtic Name: 1-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-3-(2-propan-2-ylphenyl)urea Openeye Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-isopropylphenyl)urea CAS Name: 1-[3-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]phenyl]-3-(2-propan-2-ylphenyl)urea IUPAC Name: 1-[3-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-(2-propan-2-ylphenyl)urea Traditional Name: 1-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-3-o-cumenyl-urea Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)NC2=CC=CC(=C2)C(=O)C3=CN(C4=C3C(=NC=N4)N)C(C)C

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)NC2=CC=CC(=C2)C(=O)C3=CN(C4=C3C(=NC=N4)N)C(C)C

InChI

InChI=1S/C26H28N6O2/c1-15(2)19-10-5-6-11-21(19)31-26(34)30-18-9-7-8-17(12-18)23(33)20-13-32(16(3)4)25-22(20)24(27)28-14-29-25/h5-16H,1-4H3,(H2,27,28,29)(H2,30,31,34)