5,6-dimethyl-2-[(E)-3-oxidanylidene-1-(4-piperidin-1-ylphenyl)-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-(4-piperidin-1-ylphenyl)-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-[4-(1-piperidyl)phenyl]-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(E)-3-oxo-1-[4-(1-piperidinyl)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-(4-piperidin-1-ylphenyl)-3-pyrrolidin-1-ylprop-1-en-2-yl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(E)-2-(4-piperidinophenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C26H30N4O2S MolecularWeight: 462.607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CC=C(C=C3)N4CCCCC4)C(=O)N5CCCC5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)/C(=C\C3=CC=C(C=C3)N4CCCCC4)/C(=O)N5CCCC5)C

InChI

InChI=1S/C26H30N4O2S/c1-17-18(2)33-25-22(17)24(31)27-23(28-25)21(26(32)30-14-6-7-15-30)16-19-8-10-20(11-9-19)29-12-4-3-5-13-29/h8-11,16H,3-7,12-15H2,1-2H3,(H,27,28,31)/b21-16+