3-azanyl-5-[5-[(5,6-dimethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[5-[(5,6-dimethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[5-[[5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[5-[[5,6-dimethyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]amino]pentyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[5-[(5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[5-[[5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentyl]-1H-pyrazole-4-carbonitrile Formula: C22H24N8S MolecularWeight: 432.54456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCCCCC3=C(C(=NN3)N)C#N)C4=CN=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCCCCC3=C(C(=NN3)N)C#N)C4=CN=CC=C4)C

InChI

InChI=1S/C22H24N8S/c1-13-14(2)31-22-18(13)21(27-20(28-22)15-7-6-9-25-12-15)26-10-5-3-4-8-17-16(11-23)19(24)30-29-17/h6-7,9,12H,3-5,8,10H2,1-2H3,(H3,24,29,30)(H,26,27,28)