3-[[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzenecarbonitrile Openeye Name: 3-[[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzonitrile CAS Name: 3-[[5-(4-ethylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]benzonitrile IUPAC Name: 3-[[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzonitrile Traditional Name: 3-[[5-(4-ethylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzonitrile Formula: C21H16N4S MolecularWeight: 356.44354

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=CC(=C4)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H16N4S/c1-2-14-6-8-16(9-7-14)18-12-26-21-19(18)20(23-13-24-21)25-17-5-3-4-15(10-17)11-22/h3-10,12-13H,2H2,1H3,(H,23,24,25)