5,6-dimethyl-2-[(E)-3-oxidanylidene-1-(1-phenylpyrazol-4-yl)-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-(1-phenylpyrazol-4-yl)-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-(1-phenylpyrazol-4-yl)-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(E)-3-oxo-1-(1-phenyl-4-pyrazolyl)-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-(1-phenylpyrazol-4-yl)-3-pyrrolidin-1-ylprop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(E)-2-(1-phenylpyrazol-4-yl)-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CN(N=C3)C4=CC=CC=C4)C(=O)N5CCCC5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)/C(=C\C3=CN(N=C3)C4=CC=CC=C4)/C(=O)N5CCCC5)C

InChI

InChI=1S/C24H23N5O2S/c1-15-16(2)32-23-20(15)22(30)26-21(27-23)19(24(31)28-10-6-7-11-28)12-17-13-25-29(14-17)18-8-4-3-5-9-18/h3-5,8-9,12-14H,6-7,10-11H2,1-2H3,(H,26,27,30)/b19-12+