3-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4-hexoxyphenyl)carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 3-bromo-N-[(4-hexoxyphenyl)carbamothioyl]-4-isopropoxy-benzamide CAS Name: 3-bromo-N-[(4-hexoxyanilino)-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: 3-bromo-N-[(4-hexoxyphenyl)carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 3-bromo-N-[(4-hexoxyphenyl)thiocarbamoyl]-4-isopropoxy-benzamide Formula: C23H29BrN2O3S MolecularWeight: 493.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC(C)C)Br

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC(C)C)Br

InChI

InChI=1S/C23H29BrN2O3S/c1-4-5-6-7-14-28-19-11-9-18(10-12-19)25-23(30)26-22(27)17-8-13-21(20(24)15-17)29-16(2)3/h8-13,15-16H,4-7,14H2,1-3H3,(H2,25,26,27,30)