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

Systemtic Name: 3-[4-azanyl-6-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 3-(4-amino-6-benzyl-thieno[2,3-d]pyrimidin-2-yl)benzonitrile CAS Name: 3-[4-amino-6-(phenylmethyl)-2-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 3-(4-amino-6-benzylthieno[2,3-d]pyrimidin-2-yl)benzonitrile Traditional Name: 3-(4-amino-6-benzyl-thieno[2,3-d]pyrimidin-2-yl)benzonitrile Formula: C20H14N4S MolecularWeight: 342.41696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(N=C(N=C3S2)C4=CC=CC(=C4)C#N)N

InChI

InChI=1S/C20H14N4S/c21-12-14-7-4-8-15(9-14)19-23-18(22)17-11-16(25-20(17)24-19)10-13-5-2-1-3-6-13/h1-9,11H,10H2,(H2,22,23,24)