N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]hex-5-ynamide

Systemtic Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]hex-5-ynamide Openeye Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]hex-5-ynamide CAS Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-5-hexynamide IUPAC Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]hex-5-ynamide Traditional Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]hex-5-ynamide Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC#C

Isomeric SMILES

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCC#C

InChI

InChI=1S/C17H20N2O3S2/c1-3-4-5-6-16(20)18-13-7-8-14-15(11-13)24-17(19-14)23-12-22-10-9-21-2/h1,7-8,11H,4-6,9-10,12H2,2H3,(H,18,20)