3-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methoxypyridin-3-yl)propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methoxypyridin-3-yl)propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methoxy-3-pyridyl)propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(6-methoxy-3-pyridinyl)-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methoxypyridin-3-yl)propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(6-methoxy-3-pyridyl)propane-1-sulfonamide Formula: C16H17N3O3S3 MolecularWeight: 395.51948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=NC=C(C=C1)NS(=O)(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H17N3O3S3/c1-22-15-8-7-12(11-17-15)19-25(20,21)10-4-9-23-16-18-13-5-2-3-6-14(13)24-16/h2-3,5-8,11,19H,4,9-10H2,1H3