N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(4S)-thiochroman-4-yl]phthalazine-1-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(4S)-thiochroman-4-yl]phthalazine-1-carboxamide Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N[C@H]3CCSC4=CC=CC=C34

InChI

InChI=1S/C19H17N3O2S/c1-22-19(24)13-7-3-2-6-12(13)17(21-22)18(23)20-15-10-11-25-16-9-5-4-8-14(15)16/h2-9,15H,10-11H2,1H3,(H,20,23)/t15-/m0/s1