5-bromanyl-2-butoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[[4-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[[4-[methyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C26H26BrN3O3S MolecularWeight: 540.47194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C26H26BrN3O3S/c1-3-4-16-33-23-15-12-19(27)17-22(23)24(31)29-26(34)28-20-13-10-18(11-14-20)25(32)30(2)21-8-6-5-7-9-21/h5-15,17H,3-4,16H2,1-2H3,(H2,28,29,31,34)