4-tert-butyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]benzamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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