3-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O4S/c1-13(2)9-10-28-18-7-5-14(11-16(18)22)20(25)24-21(29)23-17-12-15(26-3)6-8-19(17)27-4/h5-8,11-13H,9-10H2,1-4H3,(H2,23,24,25,29)