3-bromanyl-4-(3-methylbutoxy)-N-[(2-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[(2-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-isopentyloxy-N-[(2-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-(3-methylbutoxy)-N-[(2-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(3-methylbutoxy)-N-[(2-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-isoamoxy-N-[(2-nitrophenyl)thiocarbamoyl]benzamide Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2[N+](=O)[O-])Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2[N+](=O)[O-])Br

InChI

InChI=1S/C19H20BrN3O4S/c1-12(2)9-10-27-17-8-7-13(11-14(17)20)18(24)22-19(28)21-15-5-3-4-6-16(15)23(25)26/h3-8,11-12H,9-10H2,1-2H3,(H2,21,22,24,28)