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

Systemtic Name: 3-butan-2-yloxy-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide Openeye Name: N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]-3-sec-butoxy-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-4-12(2)27-15-7-5-6-13(10-15)18(23)21-19(28)20-16-9-8-14(26-3)11-17(16)22(24)25/h5-12H,4H2,1-3H3,(H2,20,21,23,28)