3-[4-azanyl-6-(1-phenylethyl)thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[4-azanyl-6-(1-phenylethyl)thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-amino-6-(1-phenylethyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile CAS Name: 3-[4-amino-6-(1-phenylethyl)-2-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 3-[4-amino-6-(1-phenylethyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Traditional Name: 3-[4-amino-6-(1-phenylethyl)thieno[2,3-d]pyrimidin-2-yl]benzonitrile Formula: C21H16N4S MolecularWeight: 356.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

Isomeric SMILES

CC(C1=CC=CC=C1)C2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

InChI

InChI=1S/C21H16N4S/c1-13(15-7-3-2-4-8-15)18-11-17-19(23)24-20(25-21(17)26-18)16-9-5-6-14(10-16)12-22/h2-11,13H,1H3,(H2,23,24,25)