N-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-5-chloranyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonylphenyl]-5-chloranyl-2-methoxy-benzenesulfonamide Openeye Name: N-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-5-chloro-2-methoxy-benzenesulfonamide CAS Name: N-[3-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]phenyl]-5-chloro-2-methoxybenzenesulfonamide IUPAC Name: N-[3-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-5-chloro-2-methoxybenzenesulfonamide Traditional Name: N-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)phenyl]-5-chloro-2-methoxy-benzenesulfonamide Formula: C23H22ClN5O4S MolecularWeight: 499.96988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C23H22ClN5O4S/c1-13(2)29-11-17(20-22(25)26-12-27-23(20)29)21(30)14-5-4-6-16(9-14)28-34(31,32)19-10-15(24)7-8-18(19)33-3/h4-13,28H,1-3H3,(H2,25,26,27)