2-[2-(4-acetamidophenyl)sulfanylethanoyl-ethyl-amino]-N-(5-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[2-(4-acetamidophenyl)sulfanylethanoyl-ethyl-amino]-N-(5-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]-ethyl-amino]-N-(5-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[[2-[(4-acetamidophenyl)thio]-1-oxoethyl]-ethylamino]-N-(5-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[[2-(4-acetamidophenyl)sulfanylacetyl]-ethylamino]-N-(5-chloro-2-methylphenyl)acetamide Traditional Name: 2-[[2-[(4-acetamidophenyl)thio]acetyl]-ethyl-amino]-N-(5-chloro-2-methyl-phenyl)acetamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)CSC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)CSC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C21H24ClN3O3S/c1-4-25(12-20(27)24-19-11-16(22)6-5-14(19)2)21(28)13-29-18-9-7-17(8-10-18)23-15(3)26/h5-11H,4,12-13H2,1-3H3,(H,23,26)(H,24,27)