3-bromanyl-4-(2-methoxyethoxy)-N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]benzamide Openeye Name: 3-bromo-N-[(4-isopropoxyphenyl)methylcarbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[[(4-propan-2-yloxyphenyl)methylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-propan-2-yloxyphenyl)methylcarbamothioyl]benzamide Traditional Name: 3-bromo-N-[(4-isopropoxybenzyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

InChI

InChI=1S/C21H25BrN2O4S/c1-14(2)28-17-7-4-15(5-8-17)13-23-21(29)24-20(25)16-6-9-19(18(22)12-16)27-11-10-26-3/h4-9,12,14H,10-11,13H2,1-3H3,(H2,23,24,25,29)