(2R)-N-cyclopentyl-2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-cyclopentyl-2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-2-[3-allyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-cyclopentyl-propanamide CAS Name: (2R)-N-cyclopentyl-2-[[5-(4-methylphenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]propanamide IUPAC Name: (2R)-N-cyclopentyl-2-[5-(4-methylphenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Traditional Name: (2R)-2-[[3-allyl-4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-cyclopentyl-propionamide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SC(C)C(=O)NC4CCCC4)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)S[C@H](C)C(=O)NC4CCCC4)CC=C

InChI

InChI=1S/C24H27N3O2S2/c1-4-13-27-23(29)20-19(17-11-9-15(2)10-12-17)14-30-22(20)26-24(27)31-16(3)21(28)25-18-7-5-6-8-18/h4,9-12,14,16,18H,1,5-8,13H2,2-3H3,(H,25,28)/t16-/m1/s1