N-[(2,3-dimethyl-6-nitro-phenyl)carbamothioyl]-4-ethyl-benzamide

Systemtic Name: N-[(2,3-dimethyl-6-nitro-phenyl)carbamothioyl]-4-ethyl-benzamide Openeye Name: N-[(2,3-dimethyl-6-nitro-phenyl)carbamothioyl]-4-ethyl-benzamide CAS Name: N-[(2,3-dimethyl-6-nitroanilino)-sulfanylidenemethyl]-4-ethylbenzamide IUPAC Name: N-[(2,3-dimethyl-6-nitrophenyl)carbamothioyl]-4-ethylbenzamide Traditional Name: N-[(2,3-dimethyl-6-nitro-phenyl)thiocarbamoyl]-4-ethyl-benzamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c1-4-13-6-8-14(9-7-13)17(22)20-18(25)19-16-12(3)11(2)5-10-15(16)21(23)24/h5-10H,4H2,1-3H3,(H2,19,20,22,25)