2-(2-chloranylethanoylamino)-3-methyl-N-[4-[3-methylbutyl(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]pentanamide

Systemtic Name: 2-(2-chloranylethanoylamino)-3-methyl-N-[4-[3-methylbutyl(phenylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]pentanamide Openeye Name: N-[3-[benzenesulfonyl(isopentyl)amino]-1-benzyl-2-hydroxy-propyl]-2-[(2-chloroacetyl)amino]-3-methyl-pentanamide CAS Name: N-[4-[benzenesulfonyl(3-methylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-[(2-chloro-1-oxoethyl)amino]-3-methylpentanamide IUPAC Name: N-[4-[benzenesulfonyl(3-methylbutyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-[(2-chloroacetyl)amino]-3-methylpentanamide Traditional Name: N-[1-benzyl-3-[besyl(isoamyl)amino]-2-hydroxy-propyl]-2-[(2-chloroacetyl)amino]-3-methyl-valeramide Formula: C29H42ClN3O5S MolecularWeight: 580.17888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CCC(C)C)S(=O)(=O)C2=CC=CC=C2)O)NC(=O)CCl

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CCC(C)C)S(=O)(=O)C2=CC=CC=C2)O)NC(=O)CCl

InChI

InChI=1S/C29H42ClN3O5S/c1-5-22(4)28(32-27(35)19-30)29(36)31-25(18-23-12-8-6-9-13-23)26(34)20-33(17-16-21(2)3)39(37,38)24-14-10-7-11-15-24/h6-15,21-22,25-26,28,34H,5,16-20H2,1-4H3,(H,31,36)(H,32,35)