5-bromanyl-N-morpholin-4-ylcarbothioyl-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-morpholin-4-ylcarbothioyl-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(morpholine-4-carbothioyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[4-morpholinyl(sulfanylidene)methyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(morpholine-4-carbothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(morpholine-4-carbothioyl)-2-phenethyloxy-benzamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

C1COCCN1C(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C20H21BrN2O3S/c21-16-6-7-18(26-11-8-15-4-2-1-3-5-15)17(14-16)19(24)22-20(27)23-9-12-25-13-10-23/h1-7,14H,8-13H2,(H,22,24,27)