5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]quinazolin-4-one

Systemtic Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]quinazolin-4-one Openeye Name: 2-[2-benzyloxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]-5-methyl-3-phenyl-quinazolin-4-one CAS Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]-4-quinazolinone IUPAC Name: 5-methyl-3-phenyl-2-[2-phenylmethoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]quinazolin-4-one Traditional Name: 2-[2-benzoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)ethyl]-5-methyl-3-phenyl-quinazolin-4-one Formula: C30H26N6O2 MolecularWeight: 502.56644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C(COCC4=CC=CC=C4)NC5=NC=NC6=C5C=CN6

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3)C(COCC4=CC=CC=C4)NC5=NC=NC6=C5C=CN6

InChI

InChI=1S/C30H26N6O2/c1-20-9-8-14-24-26(20)30(37)36(22-12-6-3-7-13-22)29(35-24)25(18-38-17-21-10-4-2-5-11-21)34-28-23-15-16-31-27(23)32-19-33-28/h2-16,19,25H,17-18H2,1H3,(H2,31,32,33,34)