4-[6-(1,3-benzothiazol-2-ylmethylsulfanyl)pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-(1,3-benzothiazol-2-ylmethylsulfanyl)pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-(1,3-benzothiazol-2-ylmethylthio)-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-(1,3-benzothiazol-2-ylmethylsulfanyl)pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-(1,3-benzothiazol-2-ylmethylthio)-3-pyridyl]sulfonyl]morpholine Formula: C17H17N3O3S3 MolecularWeight: 407.53018

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H17N3O3S3/c21-26(22,20-7-9-23-10-8-20)13-5-6-16(18-11-13)24-12-17-19-14-3-1-2-4-15(14)25-17/h1-6,11H,7-10,12H2