4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)methyl]-8-[[(3S,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione

Systemtic Name: 4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)methyl]-8-[[(3S,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione Openeye Name: 4-isobutyl-2-[(4-methylsulfonylphenyl)methyl]-8-[[(3S,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione CAS Name: 4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)methyl]-8-[[(3S,4S)-4-phenyl-3-pyrrolidinyl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione IUPAC Name: 4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)methyl]-8-[[(3S,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione Traditional Name: 4-isobutyl-2-(4-mesylbenzyl)-8-[[(3S,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,4,8-triazaspiro[4.5]decane-1,3-quinone Formula: C30H40N4O4S MolecularWeight: 552.728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)N(C(=O)C12CCN(CC2)CC3CNCC3C4=CC=CC=C4)CC5=CC=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC(C)CN1C(=O)N(C(=O)C12CCN(CC2)C[C@@H]3CNC[C@@H]3C4=CC=CC=C4)CC5=CC=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C30H40N4O4S/c1-22(2)19-34-29(36)33(20-23-9-11-26(12-10-23)39(3,37)38)28(35)30(34)13-15-32(16-14-30)21-25-17-31-18-27(25)24-7-5-4-6-8-24/h4-12,22,25,27,31H,13-21H2,1-3H3/t25-,27+/m0/s1