2-azanyl-N-(2-tert-butylsulfanylethyl)-4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]pentanamide

Systemtic Name: 2-azanyl-N-(2-tert-butylsulfanylethyl)-4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]pentanamide Openeye Name: 2-amino-N-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-N-(2-tert-butylsulfanylethyl)-4-methyl-pentanamide CAS Name: 2-amino-N-[2-(tert-butylthio)ethyl]-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide IUPAC Name: 2-amino-N-(2-tert-butylsulfanylethyl)-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide Traditional Name: 2-amino-N-[1-benzyl-2-keto-2-(methylamino)ethyl]-N-[2-(tert-butylthio)ethyl]-4-methyl-valeramide Formula: C22H37N3O2S MolecularWeight: 407.61308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(CCSC(C)(C)C)C(CC1=CC=CC=C1)C(=O)NC)N

Isomeric SMILES

CC(C)CC(C(=O)N(CCSC(C)(C)C)C(CC1=CC=CC=C1)C(=O)NC)N

InChI

InChI=1S/C22H37N3O2S/c1-16(2)14-18(23)21(27)25(12-13-28-22(3,4)5)19(20(26)24-6)15-17-10-8-7-9-11-17/h7-11,16,18-19H,12-15,23H2,1-6H3,(H,24,26)