1-[4-(azepan-1-yl)phenyl]sulfonyl-4-oxidanyl-pyrrolidine-2-thione

Systemtic Name: 1-[4-(azepan-1-yl)phenyl]sulfonyl-4-oxidanyl-pyrrolidine-2-thione Openeye Name: 1-[4-(azepan-1-yl)phenyl]sulfonyl-4-hydroxy-pyrrolidine-2-thione CAS Name: 1-[4-(1-azepanyl)phenyl]sulfonyl-4-hydroxy-2-pyrrolidinethione IUPAC Name: 1-[4-(azepan-1-yl)phenyl]sulfonyl-4-hydroxypyrrolidine-2-thione Traditional Name: 1-[4-(azepan-1-yl)phenyl]sulfonyl-4-hydroxy-pyrrolidine-2-thione Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CC(CC3=S)O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)S(=O)(=O)N3CC(CC3=S)O

InChI

InChI=1S/C16H22N2O3S2/c19-14-11-16(22)18(12-14)23(20,21)15-7-5-13(6-8-15)17-9-3-1-2-4-10-17/h5-8,14,19H,1-4,9-12H2