(3S)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3)C(=O)N

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3)C(=O)N

InChI

InChI=1S/C23H20N4O2S/c24-21(28)18-10-15-8-4-5-9-16(15)11-27(18)12-19-25-22(29)20-17(13-30-23(20)26-19)14-6-2-1-3-7-14/h1-9,13,18H,10-12H2,(H2,24,28)(H,25,26,29)/t18-/m0/s1