4-tert-butyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[(4-methyl-3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(4-methyl-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(4-methyl-3-nitro-phenyl)thiocarbamoyl]benzamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-12-5-10-15(11-16(12)22(24)25)20-18(26)21-17(23)13-6-8-14(9-7-13)19(2,3)4/h5-11H,1-4H3,(H2,20,21,23,26)