3-butan-2-yloxy-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-butan-2-yloxy-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: N-[(4-methyl-3-nitro-phenyl)carbamothioyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[(4-methyl-3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-[(4-methyl-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(4-methyl-3-nitro-phenyl)thiocarbamoyl]-3-sec-butoxy-benzamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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