dimethyl-[2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethyl]azanium Openeye Name: dimethyl-[2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]ethyl]ammonium CAS Name: dimethyl-[2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]ethyl]ammonium IUPAC Name: dimethyl-[2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethyl]azanium Traditional Name: dimethyl-[2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]ethyl]ammonium Formula: C16H24N3O3S2+ MolecularWeight: 370.51006

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+](C)CCSC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C16H23N3O3S2/c1-18(2)10-11-23-16-17-14-12-13(6-7-15(14)22-16)24(20,21)19-8-4-3-5-9-19/h6-7,12H,3-5,8-11H2,1-2H3/p+1