N-methyl-N-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-methyl-N-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-methyl-N-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)-3-piperidyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-methyl-N-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)-3-piperidinyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-methyl-N-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: methyl-[4-methyl-1-(5-methyl-1,3-benzoxazol-2-yl)-3-piperidyl]-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine Formula: C21H24N6O MolecularWeight: 376.45486

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C4=NC5=C(O4)C=CC(=C5)C

Isomeric SMILES

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C4=NC5=C(O4)C=CC(=C5)C

InChI

InChI=1S/C21H24N6O/c1-13-4-5-18-16(10-13)25-21(28-18)27-9-7-14(2)17(11-27)26(3)20-15-6-8-22-19(15)23-12-24-20/h4-6,8,10,12,14,17H,7,9,11H2,1-3H3,(H,22,23,24)