2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanophenyl)butanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanophenyl)butanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanophenyl)butanamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-cyanophenyl)butanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-cyanophenyl)butanamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-cyanophenyl)butyramide Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H15N3OS2/c1-2-15(17(22)20-13-8-4-3-7-12(13)11-19)23-18-21-14-9-5-6-10-16(14)24-18/h3-10,15H,2H2,1H3,(H,20,22)