3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-[(2R)-4-phenylbutan-2-yl]propanamide

Systemtic Name: 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-[(2R)-4-phenylbutan-2-yl]propanamide Openeye Name: 3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-N-[(1R)-1-methyl-3-phenyl-propyl]propanamide CAS Name: 3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-[(2R)-4-phenylbutan-2-yl]propanamide IUPAC Name: 3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[(2R)-4-phenylbutan-2-yl]propanamide Traditional Name: 3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)-N-[(1R)-1-methyl-3-phenyl-propyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NC(C)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)N[C@H](C)CCC3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O2S/c1-14(9-10-17-7-5-4-6-8-17)23-18(25)11-12-24-13-22-20-19(21(24)26)15(2)16(3)27-20/h4-8,13-14H,9-12H2,1-3H3,(H,23,25)/t14-/m1/s1