2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[3-(phenylthio)propyl]acetamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O4S2/c1-16(24)22-17-9-11-19(12-10-17)29(26,27)23(2)15-20(25)21-13-6-14-28-18-7-4-3-5-8-18/h3-5,7-12H,6,13-15H2,1-2H3,(H,21,25)(H,22,24)