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

Systemtic Name: 5-bromanyl-2-hexoxy-N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]benzamide Openeye Name: 5-bromo-2-hexoxy-N-[(4-isopropoxyphenyl)methylcarbamothioyl]benzamide CAS Name: 5-bromo-2-hexoxy-N-[[(4-propan-2-yloxyphenyl)methylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-hexoxy-N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]benzamide Traditional Name: 5-bromo-2-hexoxy-N-[(4-isopropoxybenzyl)thiocarbamoyl]benzamide Formula: C24H31BrN2O3S MolecularWeight: 507.48354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NCC2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NCC2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C24H31BrN2O3S/c1-4-5-6-7-14-29-22-13-10-19(25)15-21(22)23(28)27-24(31)26-16-18-8-11-20(12-9-18)30-17(2)3/h8-13,15,17H,4-7,14,16H2,1-3H3,(H2,26,27,28,31)