N-[(1-butylsulfonyl-4-methyl-piperidin-3-yl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(1-butylsulfonyl-4-methyl-piperidin-3-yl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-[(1-butylsulfonyl-4-methyl-3-piperidyl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-[(1-butylsulfonyl-4-methyl-3-piperidinyl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-[(1-butylsulfonyl-4-methylpiperidin-3-yl)methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (1-butylsulfonyl-4-methyl-3-piperidyl)methyl-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine Formula: C17H27N5O2S MolecularWeight: 365.49358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC(C(C1)CNC2=NC=NC3=C2C=CN3)C

Isomeric SMILES

CCCCS(=O)(=O)N1CCC(C(C1)CNC2=NC=NC3=C2C=CN3)C

InChI

InChI=1S/C17H27N5O2S/c1-3-4-9-25(23,24)22-8-6-13(2)14(11-22)10-19-17-15-5-7-18-16(15)20-12-21-17/h5,7,12-14H,3-4,6,8-11H2,1-2H3,(H2,18,19,20,21)