N-[2-[di(propan-2-yl)amino]-4-oxidanylidene-1,3-benzothiazin-6-yl]-3-nitro-benzamide

Systemtic Name: N-[2-[di(propan-2-yl)amino]-4-oxidanylidene-1,3-benzothiazin-6-yl]-3-nitro-benzamide Openeye Name: N-[2-(diisopropylamino)-4-oxo-1,3-benzothiazin-6-yl]-3-nitro-benzamide CAS Name: N-[2-[di(propan-2-yl)amino]-4-oxo-1,3-benzothiazin-6-yl]-3-nitrobenzamide IUPAC Name: N-[2-[di(propan-2-yl)amino]-4-oxo-1,3-benzothiazin-6-yl]-3-nitrobenzamide Traditional Name: N-[2-(diisopropylamino)-4-keto-1,3-benzothiazin-6-yl]-3-nitro-benzamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=NC(=O)C2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC(C)N(C1=NC(=O)C2=C(S1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C21H22N4O4S/c1-12(2)24(13(3)4)21-23-20(27)17-11-15(8-9-18(17)30-21)22-19(26)14-6-5-7-16(10-14)25(28)29/h5-13H,1-4H3,(H,22,26)