methyl N-[3-[(2-chlorophenyl)-oxidanyl-methyl]-5-(3-phenylmethoxyphenyl)sulfanyl-hexan-3-yl]carbamate

Systemtic Name: methyl N-[3-[(2-chlorophenyl)-oxidanyl-methyl]-5-(3-phenylmethoxyphenyl)sulfanyl-hexan-3-yl]carbamate Openeye Name: methyl N-[3-(3-benzyloxyphenyl)sulfanyl-1-[(2-chlorophenyl)-hydroxy-methyl]-1-ethyl-butyl]carbamate CAS Name: N-[3-[(2-chlorophenyl)-hydroxymethyl]-5-[(3-phenylmethoxyphenyl)thio]hexan-3-yl]carbamic acid methyl ester IUPAC Name: methyl N-[3-[(2-chlorophenyl)-hydroxymethyl]-5-(3-phenylmethoxyphenyl)sulfanylhexan-3-yl]carbamate Traditional Name: N-[3-[(3-benzoxyphenyl)thio]-1-[(2-chlorophenyl)-hydroxy-methyl]-1-ethyl-butyl]carbamic acid methyl ester Formula: C28H32ClNO4S MolecularWeight: 514.07598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)SC1=CC=CC(=C1)OCC2=CC=CC=C2)(C(C3=CC=CC=C3Cl)O)NC(=O)OC

Isomeric SMILES

CCC(CC(C)SC1=CC=CC(=C1)OCC2=CC=CC=C2)(C(C3=CC=CC=C3Cl)O)NC(=O)OC

InChI

InChI=1S/C28H32ClNO4S/c1-4-28(30-27(32)33-3,26(31)24-15-8-9-16-25(24)29)18-20(2)35-23-14-10-13-22(17-23)34-19-21-11-6-5-7-12-21/h5-17,20,26,31H,4,18-19H2,1-3H3,(H,30,32)