(2R)-N-cyclopropyl-2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: (2R)-N-cyclopropyl-2-(5,6-dimethyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: (2R)-2-(3-allyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2R)-N-cyclopropyl-2-[(5,6-dimethyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: (2R)-N-cyclopropyl-2-(5,6-dimethyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: (2R)-2-[(3-allyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C3=CC=CC=C3)C(=O)NC4CC4)CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)S[C@H](C3=CC=CC=C3)C(=O)NC4CC4)CC=C)C

InChI

InChI=1S/C22H23N3O2S2/c1-4-12-25-21(27)17-13(2)14(3)28-20(17)24-22(25)29-18(15-8-6-5-7-9-15)19(26)23-16-10-11-16/h4-9,16,18H,1,10-12H2,2-3H3,(H,23,26)/t18-/m1/s1