N-[2-(phenylmethylsulfanyl)ethyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide

Systemtic Name: N-[2-(phenylmethylsulfanyl)ethyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-(2-benzylsulfanylethyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-(2-benzylsulfanylethyl)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(N-besyl-4-isopropyl-anilino)acetamide Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H30N2O3S2/c1-21(2)23-13-15-24(16-14-23)28(33(30,31)25-11-7-4-8-12-25)19-26(29)27-17-18-32-20-22-9-5-3-6-10-22/h3-16,21H,17-20H2,1-2H3,(H,27,29)