3-[3-phenyl-5-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3-phenyl-5-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]pyrazol-1-yl]propanenitrile Openeye Name: 3-[3-phenyl-5-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]pyrazol-1-yl]propanenitrile CAS Name: 3-[3-phenyl-5-[(6-phenyl-4-thieno[3,2-d]pyrimidinyl)amino]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3-phenyl-5-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]pyrazol-1-yl]propanenitrile Traditional Name: 3-[3-phenyl-5-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]pyrazol-1-yl]propionitrile Formula: C24H18N6S MolecularWeight: 422.50492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)C(=NC=N3)NC4=CC(=NN4CCC#N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)C(=NC=N3)NC4=CC(=NN4CCC#N)C5=CC=CC=C5

InChI

InChI=1S/C24H18N6S/c25-12-7-13-30-22(15-19(29-30)17-8-3-1-4-9-17)28-24-23-20(26-16-27-24)14-21(31-23)18-10-5-2-6-11-18/h1-6,8-11,14-16H,7,13H2,(H,26,27,28)