2-[butan-2-yl(2-phenylsulfanylethanoyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[butan-2-yl(2-phenylsulfanylethanoyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[(5-methyl-2-thienyl)methyl]-2-[(2-phenylsulfanylacetyl)-sec-butyl-amino]acetamide CAS Name: 2-[butan-2-yl-[1-oxo-2-(phenylthio)ethyl]amino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[butan-2-yl-(2-phenylsulfanylacetyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-N-[(5-methyl-2-thienyl)methyl]-2-[[2-(phenylthio)acetyl]-sec-butyl-amino]acetamide Formula: C27H32N2O2S2 MolecularWeight: 480.68518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C27H32N2O2S2/c1-4-21(2)29(27(31)20-32-24-13-9-6-10-14-24)19-26(30)28(17-23-11-7-5-8-12-23)18-25-16-15-22(3)33-25/h5-16,21H,4,17-20H2,1-3H3