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

Systemtic Name: N-[[1-(1,3-benzothiazol-2-yl)-4-methyl-piperidin-3-yl]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-[[1-(1,3-benzothiazol-2-yl)-4-methyl-3-piperidyl]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-[[1-(1,3-benzothiazol-2-yl)-4-methyl-3-piperidinyl]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-[[1-(1,3-benzothiazol-2-yl)-4-methylpiperidin-3-yl]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [1-(1,3-benzothiazol-2-yl)-4-methyl-3-piperidyl]methyl-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine Formula: C20H22N6S MolecularWeight: 378.49388

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1CNC2=NC=NC3=C2C=CN3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1CCN(CC1CNC2=NC=NC3=C2C=CN3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H22N6S/c1-13-7-9-26(20-25-16-4-2-3-5-17(16)27-20)11-14(13)10-22-19-15-6-8-21-18(15)23-12-24-19/h2-6,8,12-14H,7,9-11H2,1H3,(H2,21,22,23,24)