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

Systemtic Name: 3-bromanyl-N-[(4-ethanoylphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: N-[(4-acetylphenyl)carbamothioyl]-3-bromo-4-isopentyloxy-benzamide CAS Name: N-[(4-acetylanilino)-sulfanylidenemethyl]-3-bromo-4-(3-methylbutoxy)benzamide IUPAC Name: N-[(4-acetylphenyl)carbamothioyl]-3-bromo-4-(3-methylbutoxy)benzamide Traditional Name: N-[(4-acetylphenyl)thiocarbamoyl]-3-bromo-4-isoamoxy-benzamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)C)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)C)Br

InChI

InChI=1S/C21H23BrN2O3S/c1-13(2)10-11-27-19-9-6-16(12-18(19)22)20(26)24-21(28)23-17-7-4-15(5-8-17)14(3)25/h4-9,12-13H,10-11H2,1-3H3,(H2,23,24,26,28)