2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-3-phenylsulfanyl-propanamide

Systemtic Name: 2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-3-phenylsulfanyl-propanamide Openeye Name: 2-[[isobutyl(methylsulfonyl)amino]-(4-methylpentanoyl)amino]-3-phenylsulfanyl-N-tetrahydropyran-2-yloxy-propanamide CAS Name: 2-[(4-methyl-1-oxopentyl)-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(2-oxanyloxy)-3-(phenylthio)propanamide IUPAC Name: 2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-3-phenylsulfanylpropanamide Traditional Name: 2-[[isobutyl(mesyl)amino]-(4-methylpentanoyl)amino]-3-(phenylthio)-N-tetrahydropyran-2-yloxy-propionamide Formula: C25H41N3O6S2 MolecularWeight: 543.73954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CSC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CC(C)C)S(=O)(=O)C

Isomeric SMILES

CC(C)CCC(=O)N(C(CSC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CC(C)C)S(=O)(=O)C

InChI

InChI=1S/C25H41N3O6S2/c1-19(2)14-15-23(29)28(27(17-20(3)4)36(5,31)32)22(18-35-21-11-7-6-8-12-21)25(30)26-34-24-13-9-10-16-33-24/h6-8,11-12,19-20,22,24H,9-10,13-18H2,1-5H3,(H,26,30)