(3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperazin-1-yl)thiolane 1,1-dioxide

Systemtic Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperazin-1-yl)thiolane 1,1-dioxide Openeye Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperazin-1-yl)thiolane 1,1-dioxide CAS Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methyl-1-piperazinyl)thiolane 1,1-dioxide IUPAC Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperazin-1-yl)thiolane 1,1-dioxide Traditional Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperazino)sulfolane Formula: C19H30N2O4S2 MolecularWeight: 414.5825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2N3CCN(CC3)C

InChI

InChI=1S/C19H30N2O4S2/c1-19(2,3)15-5-7-16(8-6-15)27(24,25)18-14-26(22,23)13-17(18)21-11-9-20(4)10-12-21/h5-8,17-18H,9-14H2,1-4H3/t17-,18-/m0/s1