N-[(3-nitrophenyl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O4S/c25-20(23-21(29)22-17-9-5-10-18(13-17)24(26)27)16-8-4-11-19(12-16)28-14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,22,23,25,29)