(2R,4S,5S)-5-azanyl-N-butyl-6-[(4-methoxyphenyl)sulfonyl-propan-2-yl-amino]-2-methyl-4-oxidanyl-hexanamide

Systemtic Name: (2R,4S,5S)-5-azanyl-N-butyl-6-[(4-methoxyphenyl)sulfonyl-propan-2-yl-amino]-2-methyl-4-oxidanyl-hexanamide Openeye Name: (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-[isopropyl-(4-methoxyphenyl)sulfonyl-amino]-2-methyl-hexanamide CAS Name: (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-[(4-methoxyphenyl)sulfonyl-propan-2-ylamino]-2-methylhexanamide IUPAC Name: (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-[(4-methoxyphenyl)sulfonyl-propan-2-ylamino]-2-methylhexanamide Traditional Name: (2R,4S,5S)-5-amino-N-butyl-4-hydroxy-6-[isopropyl-(4-methoxyphenyl)sulfonyl-amino]-2-methyl-hexanamide Formula: C21H37N3O5S MolecularWeight: 443.60058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CN(C(C)C)S(=O)(=O)C1=CC=C(C=C1)OC)N)O

Isomeric SMILES

CCCCNC(=O)[C@H](C)C[C@@H]([C@H](CN(C(C)C)S(=O)(=O)C1=CC=C(C=C1)OC)N)O

InChI

InChI=1S/C21H37N3O5S/c1-6-7-12-23-21(26)16(4)13-20(25)19(22)14-24(15(2)3)30(27,28)18-10-8-17(29-5)9-11-18/h8-11,15-16,19-20,25H,6-7,12-14,22H2,1-5H3,(H,23,26)/t16-,19+,20+/m1/s1