N'-(3-azanyl-2-oxidanyl-5-propan-2-ylsulfanyl-pentanoyl)-3-hexylsulfanyl-benzohydrazide

Systemtic Name: N'-(3-azanyl-2-oxidanyl-5-propan-2-ylsulfanyl-pentanoyl)-3-hexylsulfanyl-benzohydrazide Openeye Name: N'-(3-amino-2-hydroxy-5-isopropylsulfanyl-pentanoyl)-3-hexylsulfanyl-benzohydrazide CAS Name: N'-[3-amino-2-hydroxy-1-oxo-5-(propan-2-ylthio)pentyl]-3-(hexylthio)benzohydrazide IUPAC Name: N'-(3-amino-2-hydroxy-5-propan-2-ylsulfanylpentanoyl)-3-hexylsulfanylbenzohydrazide Traditional Name: N'-[3-amino-2-hydroxy-5-(isopropylthio)pentanoyl]-3-(hexylthio)benzohydrazide Formula: C21H35N3O3S2 MolecularWeight: 441.6509

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=CC=CC(=C1)C(=O)NNC(=O)C(C(CCSC(C)C)N)O

Isomeric SMILES

CCCCCCSC1=CC=CC(=C1)C(=O)NNC(=O)C(C(CCSC(C)C)N)O

InChI

InChI=1S/C21H35N3O3S2/c1-4-5-6-7-12-29-17-10-8-9-16(14-17)20(26)23-24-21(27)19(25)18(22)11-13-28-15(2)3/h8-10,14-15,18-19,25H,4-7,11-13,22H2,1-3H3,(H,23,26)(H,24,27)