3-bromanyl-4-(3-methylbutoxy)-N-[(5-methyl-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(3-methylbutoxy)-N-[(5-methyl-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(2-hydroxy-5-methyl-phenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[(2-hydroxy-5-methylanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[(2-hydroxy-5-methyl-phenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-12(2)8-9-26-18-7-5-14(11-15(18)21)19(25)23-20(27)22-16-10-13(3)4-6-17(16)24/h4-7,10-12,24H,8-9H2,1-3H3,(H2,22,23,25,27)