4-butan-2-yloxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butan-2-yloxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide Openeye Name: N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-4-sec-butoxy-benzamide CAS Name: 4-butan-2-yloxy-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butan-2-yloxy-N-[(2-methyl-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]-4-sec-butoxy-benzamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O4S/c1-4-13(3)26-16-9-6-14(7-10-16)18(23)21-19(27)20-17-11-15(22(24)25)8-5-12(17)2/h5-11,13H,4H2,1-3H3,(H2,20,21,23,27)