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

Systemtic Name: 3-azanyl-5-[5-[(5,6-dimethyl-2-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[5-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[5-[(5,6-dimethyl-2-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)amino]pentyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[5-[(5,6-dimethyl-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[5-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]pentyl]-1H-pyrazole-4-carbonitrile Formula: C21H23N7S2 MolecularWeight: 437.58422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCCCCC3=C(C(=NN3)N)C#N)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCCCCC3=C(C(=NN3)N)C#N)C4=CC=CS4)C

InChI

InChI=1S/C21H23N7S2/c1-12-13(2)30-21-17(12)20(25-19(26-21)16-8-6-10-29-16)24-9-5-3-4-7-15-14(11-22)18(23)28-27-15/h6,8,10H,3-5,7,9H2,1-2H3,(H3,23,27,28)(H,24,25,26)