N-[2-[1,3-benzothiazol-2-yl(cyano)methyl]sulfanylphenyl]-2-methyl-propanamide

Systemtic Name: N-[2-[1,3-benzothiazol-2-yl(cyano)methyl]sulfanylphenyl]-2-methyl-propanamide Openeye Name: N-[2-[1,3-benzothiazol-2-yl(cyano)methyl]sulfanylphenyl]-2-methyl-propanamide CAS Name: N-[2-[[1,3-benzothiazol-2-yl(cyano)methyl]thio]phenyl]-2-methylpropanamide IUPAC Name: N-[2-[1,3-benzothiazol-2-yl(cyano)methyl]sulfanylphenyl]-2-methylpropanamide Traditional Name: N-[2-[[1,3-benzothiazol-2-yl(cyano)methyl]thio]phenyl]-2-methyl-propionamide Formula: C19H17N3OS2 MolecularWeight: 367.48778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC=C1SC(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC=C1SC(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H17N3OS2/c1-12(2)18(23)21-13-7-3-5-9-15(13)24-17(11-20)19-22-14-8-4-6-10-16(14)25-19/h3-10,12,17H,1-2H3,(H,21,23)