propan-2-yl N-[4-[4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamate

Systemtic Name: propan-2-yl N-[4-[4-[(3-chlorophenyl)amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamate Openeye Name: isopropyl N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamate CAS Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamate Traditional Name: N-[4-[4-(3-chloroanilino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]carbamic acid isopropyl ester Formula: C22H20ClN5O2 MolecularWeight: 421.8795

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)OC(=O)NC1=CC=C(C=C1)C2=CC3=C(N2)N=CN=C3NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H20ClN5O2/c1-13(2)30-22(29)27-16-8-6-14(7-9-16)19-11-18-20(24-12-25-21(18)28-19)26-17-5-3-4-15(23)10-17/h3-13H,1-2H3,(H,27,29)(H2,24,25,26,28)