5-[4-azanyl-6-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]furan-2-carbonitrile

Systemtic Name: 5-[4-azanyl-6-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]furan-2-carbonitrile Openeye Name: 5-(4-amino-6-benzyl-thieno[2,3-d]pyrimidin-2-yl)furan-2-carbonitrile CAS Name: 5-[4-amino-6-(phenylmethyl)-2-thieno[2,3-d]pyrimidinyl]-2-furancarbonitrile IUPAC Name: 5-(4-amino-6-benzylthieno[2,3-d]pyrimidin-2-yl)furan-2-carbonitrile Traditional Name: 5-(4-amino-6-benzyl-thieno[2,3-d]pyrimidin-2-yl)-2-furonitrile Formula: C18H12N4OS MolecularWeight: 332.37908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=C(N=C(N=C3S2)C4=CC=C(O4)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(N=C(N=C3S2)C4=CC=C(O4)C#N)N

InChI

InChI=1S/C18H12N4OS/c19-10-12-6-7-15(23-12)17-21-16(20)14-9-13(24-18(14)22-17)8-11-4-2-1-3-5-11/h1-7,9H,8H2,(H2,20,21,22)