N-[2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl]-3-methyl-4-nitro-benzamide CAS Name: N-[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]ethyl]-3-methyl-4-nitro-benzamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCNC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCNC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-11-10-12(6-7-14(11)21(23)24)17(22)19-9-8-18-16-13-4-2-3-5-15(13)27(25,26)20-16/h2-7,10H,8-9H2,1H3,(H,18,20)(H,19,22)