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

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]-4-methyl-3-nitro-benzamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S/c1-10-6-7-11(8-13(10)21(24)25)16(23)18-9-15(22)20-17-19-12-4-2-3-5-14(12)26-17/h2-8H,9H2,1H3,(H,18,23)(H,19,20,22)