5-azanyl-3-[3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[3-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]propyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]propyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C21H21N7S MolecularWeight: 403.50334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C21H21N7S/c1-2-15-11-16-20(25-13-26-21(16)29-15)24-10-6-9-18-17(12-22)19(23)28(27-18)14-7-4-3-5-8-14/h3-5,7-8,11,13H,2,6,9-10,23H2,1H3,(H,24,25,26)