2-[3-[(4S)-2-azanyl-3-cyano-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]ethanamide

Systemtic Name: 2-[3-[(4S)-2-azanyl-3-cyano-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]ethanamide Openeye Name: 2-[3-[(4S)-2-amino-3-cyano-5-oxo-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]acetamide CAS Name: 2-[3-[(4S)-2-amino-3-cyano-5-oxo-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]acetamide IUPAC Name: 2-[3-[(4S)-2-amino-3-cyano-5-oxo-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]acetamide Traditional Name: 2-[3-[(4S)-2-amino-3-cyano-5-keto-4H-thiochromeno[4,3-b]pyran-4-yl]phenoxy]acetamide Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C(C(=C(O3)N)C#N)C4=CC(=CC=C4)OCC(=O)N)C(=O)S2

Isomeric SMILES

C1=CC=C2C(=C1)C3=C([C@H](C(=C(O3)N)C#N)C4=CC(=CC=C4)OCC(=O)N)C(=O)S2

InChI

InChI=1S/C21H15N3O4S/c22-9-14-17(11-4-3-5-12(8-11)27-10-16(23)25)18-19(28-20(14)24)13-6-1-2-7-15(13)29-21(18)26/h1-8,17H,10,24H2,(H2,23,25)/t17-/m0/s1