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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC(C(C1)N(C)C2=NC=NC3=C2C=CN3)C

Isomeric SMILES

CCCCS(=O)(=O)N1CCC(C(C1)N(C)C2=NC=NC3=C2C=CN3)C

InChI

InChI=1S/C17H27N5O2S/c1-4-5-10-25(23,24)22-9-7-13(2)15(11-22)21(3)17-14-6-8-18-16(14)19-12-20-17/h6,8,12-13,15H,4-5,7,9-11H2,1-3H3,(H,18,19,20)