3-[6-ethyl-4-oxidanylidene-2-(phenylmethyl)thieno[2,3-d]pyrimidin-3-yl]propanenitrile

Systemtic Name: 3-[6-ethyl-4-oxidanylidene-2-(phenylmethyl)thieno[2,3-d]pyrimidin-3-yl]propanenitrile Openeye Name: 3-(2-benzyl-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanenitrile CAS Name: 3-[6-ethyl-4-oxo-2-(phenylmethyl)-3-thieno[2,3-d]pyrimidinyl]propanenitrile IUPAC Name: 3-(2-benzyl-6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanenitrile Traditional Name: 3-(2-benzyl-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)propionitrile Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CCC#N)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CCC#N)CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS/c1-2-14-12-15-17(23-14)20-16(11-13-7-4-3-5-8-13)21(18(15)22)10-6-9-19/h3-5,7-8,12H,2,6,10-11H2,1H3