N-[3-(4-methylphenyl)-4-oxidanylidene-thiochromen-2-yl]-3-nitro-benzamide

Systemtic Name: N-[3-(4-methylphenyl)-4-oxidanylidene-thiochromen-2-yl]-3-nitro-benzamide Openeye Name: 3-nitro-N-[4-oxo-3-(p-tolyl)thiochromen-2-yl]benzamide CAS Name: N-[3-(4-methylphenyl)-4-oxo-1-benzothiopyran-2-yl]-3-nitrobenzamide IUPAC Name: N-[3-(4-methylphenyl)-4-oxothiochromen-2-yl]-3-nitrobenzamide Traditional Name: N-[4-keto-3-(p-tolyl)thiochromen-2-yl]-3-nitro-benzamide Formula: C23H16N2O4S MolecularWeight: 416.44914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O4S/c1-14-9-11-15(12-10-14)20-21(26)18-7-2-3-8-19(18)30-23(20)24-22(27)16-5-4-6-17(13-16)25(28)29/h2-13H,1H3,(H,24,27)