5-bromanyl-2-hexoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-hexoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-hexoxy-N-[(4-isopropoxyphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-hexoxy-N-[(4-propan-2-yloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-hexoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-hexoxy-N-[(4-isopropoxyphenyl)thiocarbamoyl]benzamide Formula: C23H29BrN2O3S MolecularWeight: 493.45696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)C

InChI

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