N'-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(2-methylpropyl)-2-(thiophen-2-ylsulfanylmethyl)butanediamide

Systemtic Name: N'-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(2-methylpropyl)-2-(thiophen-2-ylsulfanylmethyl)butanediamide Openeye Name: N'-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-3-isobutyl-2-(2-thienylsulfanylmethyl)butanediamide CAS Name: N'-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-3-(2-methylpropyl)-2-[(thiophen-2-ylthio)methyl]butanediamide IUPAC Name: N'-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-3-(2-methylpropyl)-2-(thiophen-2-ylsulfanylmethyl)butanediamide Traditional Name: N'-[1-benzyl-2-keto-2-(methylamino)ethyl]-3-isobutyl-2-[(2-thienylthio)methyl]succinamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CSC1=CC=CS1)C(=O)N)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

Isomeric SMILES

CC(C)CC(C(CSC1=CC=CS1)C(=O)N)C(=O)NC(CC2=CC=CC=C2)C(=O)NC

InChI

InChI=1S/C23H31N3O3S2/c1-15(2)12-17(18(21(24)27)14-31-20-10-7-11-30-20)22(28)26-19(23(29)25-3)13-16-8-5-4-6-9-16/h4-11,15,17-19H,12-14H2,1-3H3,(H2,24,27)(H,25,29)(H,26,28)