2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-ynamide

Systemtic Name: 2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-ynamide Openeye Name: 2-[[isobutyl(methylsulfonyl)amino]-(4-methylpentanoyl)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-ynamide CAS Name: 2-[(4-methyl-1-oxopentyl)-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(2-oxanyloxy)-5-phenyl-4-pentynamide IUPAC Name: 2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]-N-(oxan-2-yloxy)-5-phenylpent-4-ynamide Traditional Name: 2-[[isobutyl(mesyl)amino]-(4-methylpentanoyl)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-ynamide Formula: C27H41N3O6S MolecularWeight: 535.69594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CC#CC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CC(C)C)S(=O)(=O)C

Isomeric SMILES

CC(C)CCC(=O)N(C(CC#CC1=CC=CC=C1)C(=O)NOC2CCCCO2)N(CC(C)C)S(=O)(=O)C

InChI

InChI=1S/C27H41N3O6S/c1-21(2)17-18-25(31)30(29(20-22(3)4)37(5,33)34)24(15-11-14-23-12-7-6-8-13-23)27(32)28-36-26-16-9-10-19-35-26/h6-8,12-13,21-22,24,26H,9-10,15-20H2,1-5H3,(H,28,32)