(6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridin-4-yl)methanone CAS Name: (6-cyclopropyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(6-cyclopropyl-1-propan-2-ylpyrazolo[3,4-b]pyridin-4-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridin-4-yl)methanone Formula: C24H29N5O3S MolecularWeight: 467.58376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C24H29N5O3S/c1-17(2)29-23-21(15-25-29)20(14-22(26-23)19-8-9-19)24(30)27-10-12-28(13-11-27)33(31,32)16-18-6-4-3-5-7-18/h3-7,14-15,17,19H,8-13,16H2,1-2H3