(9S)-11-butyl-9-(cyclohexylmethyl)-3-[(4-methylsulfinylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione

Systemtic Name: (9S)-11-butyl-9-(cyclohexylmethyl)-3-[(4-methylsulfinylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione Openeye Name: (9S)-11-butyl-9-(cyclohexylmethyl)-3-[(4-methylsulfinylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione CAS Name: (9S)-11-butyl-9-(cyclohexylmethyl)-3-[(4-methylsulfinylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione IUPAC Name: (9S)-11-butyl-9-(cyclohexylmethyl)-3-[(4-methylsulfinylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione Traditional Name: (9S)-11-butyl-9-(cyclohexylmethyl)-3-(4-methylsulfinylbenzyl)-3,8,11-triazaspiro[5.5]undecane-7,10-quinone Formula: C27H41N3O3S MolecularWeight: 487.69774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)S(=O)C)CC4CCCCC4

Isomeric SMILES

CCCCN1C(=O)[C@@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)S(=O)C)CC4CCCCC4

InChI

InChI=1S/C27H41N3O3S/c1-3-4-16-30-25(31)24(19-21-8-6-5-7-9-21)28-26(32)27(30)14-17-29(18-15-27)20-22-10-12-23(13-11-22)34(2)33/h10-13,21,24H,3-9,14-20H2,1-2H3,(H,28,32)/t24-,34?/m0/s1