N-[4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloranyl-phenyl]-2-(2-dimethylaminoethylsulfanyl)ethanamide

Systemtic Name: N-[4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloranyl-phenyl]-2-(2-dimethylaminoethylsulfanyl)ethanamide Openeye Name: N-[4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloro-phenyl]-2-(2-dimethylaminoethylsulfanyl)acetamide CAS Name: N-[4-[[[[(4-acetamidophenyl)thio]amino]-oxomethyl]amino]-2-chlorophenyl]-2-(2-dimethylaminoethylthio)acetamide IUPAC Name: N-[4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chlorophenyl]-2-(2-dimethylaminoethylsulfanyl)acetamide Traditional Name: N-[4-[[(4-acetamidophenyl)thio]carbamoylamino]-2-chloro-phenyl]-2-(2-dimethylaminoethylthio)acetamide Formula: C21H26ClN5O3S2 MolecularWeight: 496.04584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2=CC(=C(C=C2)NC(=O)CSCCN(C)C)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2=CC(=C(C=C2)NC(=O)CSCCN(C)C)Cl

InChI

InChI=1S/C21H26ClN5O3S2/c1-14(28)23-15-4-7-17(8-5-15)32-26-21(30)24-16-6-9-19(18(22)12-16)25-20(29)13-31-11-10-27(2)3/h4-9,12H,10-11,13H2,1-3H3,(H,23,28)(H,25,29)(H2,24,26,30)