4-[2-[1,3-benzothiazol-2-yl-(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[1,3-benzothiazol-2-yl-(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C24H20N4O4S2 MolecularWeight: 492.57

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O4S2/c1-2-15-7-10-17(11-8-15)27(24-26-18-5-3-4-6-20(18)34-24)22(29)14-33-21-12-9-16(23(25)30)13-19(21)28(31)32/h3-13H,2,14H2,1H3,(H2,25,30)