3-nitro-4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanylbenzamide Traditional Name: 4-[(2-keto-2-mesidino-ethyl)thio]-3-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C

InChI

InChI=1S/C18H19N3O4S/c1-10-6-11(2)17(12(3)7-10)20-16(22)9-26-15-5-4-13(18(19)23)8-14(15)21(24)25/h4-8H,9H2,1-3H3,(H2,19,23)(H,20,22)