N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(3-methyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C19H14N4O5S MolecularWeight: 410.40326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2SC1=NC(=O)CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O5S/c1-21-12-6-2-3-8-14(12)29-19(21)20-15(24)9-10-22-17(25)11-5-4-7-13(23(27)28)16(11)18(22)26/h2-8H,9-10H2,1H3