(2S)-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-4-oxidanylidene-2,3-dihydro-1,3-thiazine-5-carbonitrile

Systemtic Name: (2S)-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-4-oxidanylidene-2,3-dihydro-1,3-thiazine-5-carbonitrile Openeye Name: (2S)-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile CAS Name: (2S)-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile IUPAC Name: (2S)-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile Traditional Name: (2S)-4-keto-6-(3-methoxypropylamino)-2-(3-nitrophenyl)-2,3-dihydro-1,3-thiazine-5-carbonitrile Formula: C15H16N4O4S MolecularWeight: 348.37694

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C(=O)NC(S1)C2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COCCCNC1=C(C(=O)N[C@@H](S1)C2=CC(=CC=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H16N4O4S/c1-23-7-3-6-17-15-12(9-16)13(20)18-14(24-15)10-4-2-5-11(8-10)19(21)22/h2,4-5,8,14,17H,3,6-7H2,1H3,(H,18,20)/t14-/m0/s1