2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)propanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)propanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)propanamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-cyanophenyl)propanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-cyanophenyl)propanamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-cyanophenyl)propionamide Formula: C17H13N3OS2 MolecularWeight: 339.43462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H13N3OS2/c1-11(16(21)19-13-8-6-12(10-18)7-9-13)22-17-20-14-4-2-3-5-15(14)23-17/h2-9,11H,1H3,(H,19,21)