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

Systemtic Name: 3-azanyl-5-[3-[(5,6-dimethyl-2-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)-methyl-amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[(5,6-dimethyl-2-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)-methylamino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[(5,6-dimethyl-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)-methylamino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C20H21N7S2 MolecularWeight: 423.55764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N(C)CCCC3=C(C(=NN3)N)C#N)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N(C)CCCC3=C(C(=NN3)N)C#N)C4=CC=CS4)C

InChI

InChI=1S/C20H21N7S2/c1-11-12(2)29-20-16(11)19(23-18(24-20)15-7-5-9-28-15)27(3)8-4-6-14-13(10-21)17(22)26-25-14/h5,7,9H,4,6,8H2,1-3H3,(H3,22,25,26)