(4R)-3'-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]spiro[6,7-dihydro-5H-1-benzothiophene-4,5'-imidazolidine]-2',4'-dione

Systemtic Name: (4R)-3'-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]spiro[6,7-dihydro-5H-1-benzothiophene-4,5'-imidazolidine]-2',4'-dione Openeye Name: (4R)-3'-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]spiro[6,7-dihydro-5H-benzothiophene-4,5'-imidazolidine]-2',4'-dione CAS Name: (4R)-3'-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]spiro[6,7-dihydro-5H-1-benzothiophene-4,5'-imidazolidine]-2',4'-dione IUPAC Name: (4R)-3'-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]spiro[6,7-dihydro-5H-1-benzothiophene-4,5'-imidazolidine]-2',4'-dione Traditional Name: (4R)-3'-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]spiro[6,7-dihydro-5H-benzothiophene-4,5'-imidazolidine]-2',4'-quinone Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)C3(CCCC4=C3C=CS4)NC2=O)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2C(=O)[C@]3(CCCC4=C3C=CS4)NC2=O)C

InChI

InChI=1S/C21H25N3O3S/c1-4-9-23-13(2)11-15(14(23)3)17(25)12-24-19(26)21(22-20(24)27)8-5-6-18-16(21)7-10-28-18/h7,10-11H,4-6,8-9,12H2,1-3H3,(H,22,27)/t21-/m1/s1