2-[3-[(4-acetamidophenyl)sulfanylcarbamoylamino]thiomorpholin-4-yl]-2-chloranyl-2-phenyl-ethanamide

Systemtic Name: 2-[3-[(4-acetamidophenyl)sulfanylcarbamoylamino]thiomorpholin-4-yl]-2-chloranyl-2-phenyl-ethanamide Openeye Name: 2-[3-[(4-acetamidophenyl)sulfanylcarbamoylamino]thiomorpholin-4-yl]-2-chloro-2-phenyl-acetamide CAS Name: 2-[3-[[[[(4-acetamidophenyl)thio]amino]-oxomethyl]amino]-4-thiomorpholinyl]-2-chloro-2-phenylacetamide IUPAC Name: 2-[3-[(4-acetamidophenyl)sulfanylcarbamoylamino]thiomorpholin-4-yl]-2-chloro-2-phenylacetamide Traditional Name: 2-[3-[[(4-acetamidophenyl)thio]carbamoylamino]thiomorpholin-4-yl]-2-chloro-2-phenyl-acetamide Formula: C21H24ClN5O3S2 MolecularWeight: 494.02996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2CSCCN2C(C3=CC=CC=C3)(C(=O)N)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2CSCCN2C(C3=CC=CC=C3)(C(=O)N)Cl

InChI

InChI=1S/C21H24ClN5O3S2/c1-14(28)24-16-7-9-17(10-8-16)32-26-20(30)25-18-13-31-12-11-27(18)21(22,19(23)29)15-5-3-2-4-6-15/h2-10,18H,11-13H2,1H3,(H2,23,29)(H,24,28)(H2,25,26,30)