N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(methylamino)-5-nitro-benzamide Openeye Name: N-(6-chlorothiochroman-4-yl)-2-(methylamino)-5-nitro-benzamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-2-(methylamino)-5-nitrobenzamide Traditional Name: N-(6-chlorothiochroman-4-yl)-2-(methylamino)-5-nitro-benzamide Formula: C17H16ClN3O3S MolecularWeight: 377.84524

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O3S/c1-19-14-4-3-11(21(23)24)9-13(14)17(22)20-15-6-7-25-16-5-2-10(18)8-12(15)16/h2-5,8-9,15,19H,6-7H2,1H3,(H,20,22)