3-[5,6-dimethyl-2,4-bis(oxidanylidene)-3-phenyl-thieno[2,3-d]pyrimidin-1-yl]propanenitrile

Systemtic Name: 3-[5,6-dimethyl-2,4-bis(oxidanylidene)-3-phenyl-thieno[2,3-d]pyrimidin-1-yl]propanenitrile Openeye Name: 3-(5,6-dimethyl-2,4-dioxo-3-phenyl-thieno[2,3-d]pyrimidin-1-yl)propanenitrile CAS Name: 3-(5,6-dimethyl-2,4-dioxo-3-phenyl-1-thieno[2,3-d]pyrimidinyl)propanenitrile IUPAC Name: 3-(5,6-dimethyl-2,4-dioxo-3-phenylthieno[2,3-d]pyrimidin-1-yl)propanenitrile Traditional Name: 3-(2,4-diketo-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-1-yl)propionitrile Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=O)N2CCC#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=O)N2CCC#N)C3=CC=CC=C3)C

InChI

InChI=1S/C17H15N3O2S/c1-11-12(2)23-16-14(11)15(21)20(13-7-4-3-5-8-13)17(22)19(16)10-6-9-18/h3-5,7-8H,6,10H2,1-2H3