(3R)-3-[4-(7-chloranylquinazolin-4-yl)piperazin-1-ium-1-yl]thiolane 1,1-dioxide

Systemtic Name: (3R)-3-[4-(7-chloranylquinazolin-4-yl)piperazin-1-ium-1-yl]thiolane 1,1-dioxide Openeye Name: (3R)-3-[4-(7-chloroquinazolin-4-yl)piperazin-1-ium-1-yl]thiolane 1,1-dioxide CAS Name: (3R)-3-[4-(7-chloro-4-quinazolinyl)-1-piperazin-1-iumyl]thiolane 1,1-dioxide IUPAC Name: (3R)-3-[4-(7-chloroquinazolin-4-yl)piperazin-1-ium-1-yl]thiolane 1,1-dioxide Traditional Name: (3R)-3-[4-(7-chloroquinazolin-4-yl)piperazin-1-ium-1-yl]sulfolane Formula: C16H20ClN4O2S+ MolecularWeight: 367.8736

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1[NH+]2CCN(CC2)C3=NC=NC4=C3C=CC(=C4)Cl

Isomeric SMILES

C1CS(=O)(=O)C[C@@H]1[NH+]2CCN(CC2)C3=NC=NC4=C3C=CC(=C4)Cl

InChI

InChI=1S/C16H19ClN4O2S/c17-12-1-2-14-15(9-12)18-11-19-16(14)21-6-4-20(5-7-21)13-3-8-24(22,23)10-13/h1-2,9,11,13H,3-8,10H2/p+1/t13-/m1/s1