propan-2-yl 4-[4-[(6-cyclopropylsulfonyl-2-methyl-pyridin-3-yl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[4-[(6-cyclopropylsulfonyl-2-methyl-pyridin-3-yl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[4-[(6-cyclopropylsulfonyl-2-methyl-3-pyridyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(6-cyclopropylsulfonyl-2-methyl-3-pyridinyl)amino]-7-pyrrolo[2,3-d]pyrimidinyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[(6-cyclopropylsulfonyl-2-methylpyridin-3-yl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(6-cyclopropylsulfonyl-2-methyl-3-pyridyl)amino]pyrrolo[2,3-d]pyrimidin-7-yl]piperidine-1-carboxylic acid isopropyl ester Formula: C24H30N6O4S MolecularWeight: 498.5978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)S(=O)(=O)C2CC2)NC3=NC=NC4=C3C=CN4C5CCN(CC5)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=N1)S(=O)(=O)C2CC2)NC3=NC=NC4=C3C=CN4C5CCN(CC5)C(=O)OC(C)C

InChI

InChI=1S/C24H30N6O4S/c1-15(2)34-24(31)29-11-8-17(9-12-29)30-13-10-19-22(25-14-26-23(19)30)28-20-6-7-21(27-16(20)3)35(32,33)18-4-5-18/h6-7,10,13-15,17-18H,4-5,8-9,11-12H2,1-3H3,(H,25,26,28)