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

Systemtic Name: N-[3-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl-4-methoxy-phenyl]-3,5-bis(chloranyl)benzenesulfonamide Openeye Name: N-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-4-methoxy-phenyl]-3,5-dichloro-benzenesulfonamide CAS Name: N-[3-[(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-oxomethyl]-4-methoxyphenyl]-3,5-dichlorobenzenesulfonamide IUPAC Name: N-[3-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-4-methoxyphenyl]-3,5-dichlorobenzenesulfonamide Traditional Name: N-[3-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-4-methoxy-phenyl]-3,5-dichloro-benzenesulfonamide Formula: C23H21Cl2N5O4S MolecularWeight: 534.41494

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(=C4)Cl)Cl)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H21Cl2N5O4S/c1-12(2)30-10-18(20-22(26)27-11-28-23(20)30)21(31)17-9-15(4-5-19(17)34-3)29-35(32,33)16-7-13(24)6-14(25)8-16/h4-12,29H,1-3H3,(H2,26,27,28)