N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[(4-nitro-2-oxidanyl-phenyl)carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: N-[(2-hydroxy-4-nitro-phenyl)carbamothioyl]-3-isopropoxy-benzamide CAS Name: N-[(2-hydroxy-4-nitroanilino)-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: N-[(2-hydroxy-4-nitro-phenyl)thiocarbamoyl]-3-isopropoxy-benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5S/c1-10(2)25-13-5-3-4-11(8-13)16(22)19-17(26)18-14-7-6-12(20(23)24)9-15(14)21/h3-10,21H,1-2H3,(H2,18,19,22,26)