2-[3-[2-(methoxymethyl)pyrrolidin-1-yl]sulfonylpropylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[3-[2-(methoxymethyl)pyrrolidin-1-yl]sulfonylpropylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[3-[2-(methoxymethyl)pyrrolidin-1-yl]sulfonylpropylsulfanyl]-1,3-benzothiazole CAS Name: 2-[3-[[2-(methoxymethyl)-1-pyrrolidinyl]sulfonyl]propylthio]-1,3-benzothiazole IUPAC Name: 2-[3-[2-(methoxymethyl)pyrrolidin-1-yl]sulfonylpropylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[3-[2-(methoxymethyl)pyrrolidino]sulfonylpropylthio]-1,3-benzothiazole Formula: C16H22N2O3S3 MolecularWeight: 386.55248

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COCC1CCCN1S(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H22N2O3S3/c1-21-12-13-6-4-9-18(13)24(19,20)11-5-10-22-16-17-14-7-2-3-8-15(14)23-16/h2-3,7-8,13H,4-6,9-12H2,1H3