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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4Cl)OC

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4Cl)OC

InChI

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