3-butan-2-yloxy-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-butan-2-yloxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: N-[(4-nitrophenyl)carbamothioyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: N-[(4-nitrophenyl)thiocarbamoyl]-3-sec-butoxy-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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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)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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