5-bromanyl-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-2-propoxy-N-[(4-sec-butoxyphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-N-[(4-butan-2-yloxyanilino)-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[(4-butan-2-yloxyphenyl)carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-2-propoxy-N-[(4-sec-butoxyphenyl)thiocarbamoyl]benzamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)CC

InChI

InChI=1S/C21H25BrN2O3S/c1-4-12-26-19-11-6-15(22)13-18(19)20(25)24-21(28)23-16-7-9-17(10-8-16)27-14(3)5-2/h6-11,13-14H,4-5,12H2,1-3H3,(H2,23,24,25,28)