N-[6-acetamido-1-(methylamino)-1-oxidanylidene-hexan-2-yl]-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-(2-methylpropyl)butanediamide

Systemtic Name: N-[6-acetamido-1-(methylamino)-1-oxidanylidene-hexan-2-yl]-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-(2-methylpropyl)butanediamide Openeye Name: N-[5-acetamido-1-(methylcarbamoyl)pentyl]-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-isobutyl-butanediamide CAS Name: N-[6-acetamido-1-(methylamino)-1-oxohexan-2-yl]-3-[[(4-hydroxyphenyl)thio]methyl]-2-(2-methylpropyl)butanediamide IUPAC Name: N-[6-acetamido-1-(methylamino)-1-oxohexan-2-yl]-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-(2-methylpropyl)butanediamide Traditional Name: N-[5-acetamido-1-(methylcarbamoyl)pentyl]-3-[[(4-hydroxyphenyl)thio]methyl]-2-isobutyl-succinamide Formula: C24H38N4O5S MolecularWeight: 494.64732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CSC1=CC=C(C=C1)O)C(=O)N)C(=O)NC(CCCCNC(=O)C)C(=O)NC

Isomeric SMILES

CC(C)CC(C(CSC1=CC=C(C=C1)O)C(=O)N)C(=O)NC(CCCCNC(=O)C)C(=O)NC

InChI

InChI=1S/C24H38N4O5S/c1-15(2)13-19(20(22(25)31)14-34-18-10-8-17(30)9-11-18)23(32)28-21(24(33)26-4)7-5-6-12-27-16(3)29/h8-11,15,19-21,30H,5-7,12-14H2,1-4H3,(H2,25,31)(H,26,33)(H,27,29)(H,28,32)