3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-methyl-propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-methyl-propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-methyl-propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-cyanoethyl)-N-methylpropanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanoethyl)-N-methylpropanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-cyanoethyl)-N-methyl-propionamide Formula: C14H15N3OS2 MolecularWeight: 305.4184

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CCSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CN(CCC#N)C(=O)CCSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H15N3OS2/c1-17(9-4-8-15)13(18)7-10-19-14-16-11-5-2-3-6-12(11)20-14/h2-3,5-6H,4,7,9-10H2,1H3