5,6-dimethyl-2-[(E)-3-oxidanylidene-1-phenyl-3-pyrrolidin-1-yl-prop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(E)-3-oxidanylidene-1-phenyl-3-pyrrolidin-1-yl-prop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(E)-2-phenyl-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(E)-3-oxo-1-phenyl-3-(1-pyrrolidinyl)prop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(E)-3-oxo-1-phenyl-3-pyrrolidin-1-ylprop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(E)-2-phenyl-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CC=CC=C3)C(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)/C(=C\C3=CC=CC=C3)/C(=O)N4CCCC4)C

InChI

InChI=1S/C21H21N3O2S/c1-13-14(2)27-20-17(13)19(25)22-18(23-20)16(12-15-8-4-3-5-9-15)21(26)24-10-6-7-11-24/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,22,23,25)/b16-12+