2-[(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1S)-2-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]thio]-3-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1S)-2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-1-methyl-ethyl]thio]-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3C

Isomeric SMILES

C[C@@H](C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3C

InChI

InChI=1S/C25H23N3O2S2/c1-16(23(29)28-14-8-12-18-11-6-7-13-20(18)28)32-25-26-22-21(24(30)27(25)2)19(15-31-22)17-9-4-3-5-10-17/h3-7,9-11,13,15-16H,8,12,14H2,1-2H3/t16-/m0/s1