3-bromanyl-4-butoxy-N-[(3-methoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(3-methoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(3-methoxyphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[(3-methoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(3-methoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(3-methoxyphenyl)thiocarbamoyl]benzamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OC)Br

InChI

InChI=1S/C19H21BrN2O3S/c1-3-4-10-25-17-9-8-13(11-16(17)20)18(23)22-19(26)21-14-6-5-7-15(12-14)24-2/h5-9,11-12H,3-4,10H2,1-2H3,(H2,21,22,23,26)