ethyl 3-[2-(3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl)hydrazinyl]-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 3-[2-(3-azanyl-4-cyclohexyl-2-oxidanyl-butanoyl)hydrazinyl]-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxylate Openeye Name: ethyl 3-[2-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate CAS Name: 3-[(3-amino-4-cyclohexyl-2-hydroxy-1-oxobutyl)hydrazo]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(3-amino-4-cyclohexyl-2-hydroxybutanoyl)hydrazinyl]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate Traditional Name: 3-[N'-(3-amino-4-cyclohexyl-2-hydroxy-butanoyl)hydrazino]-4-keto-6,6-dimethyl-5,7-dihydroisobenzothiophene-1-carboxylic acid ethyl ester Formula: C23H35N3O5S MolecularWeight: 465.6061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)NNC(=O)C(C(CC3CCCCC3)N)O)(C)C

Isomeric SMILES

CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)NNC(=O)C(C(CC3CCCCC3)N)O)(C)C

InChI

InChI=1S/C23H35N3O5S/c1-4-31-22(30)19-14-11-23(2,3)12-16(27)17(14)21(32-19)26-25-20(29)18(28)15(24)10-13-8-6-5-7-9-13/h13,15,18,26,28H,4-12,24H2,1-3H3,(H,25,29)