N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]propionamide Formula: C24H20N4OS2 MolecularWeight: 444.5718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCCC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCCC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C24H20N4OS2/c1-15-13-16(2)26-24(19(15)14-25)30-12-11-22(29)27-18-9-7-17(8-10-18)23-28-20-5-3-4-6-21(20)31-23/h3-10,13H,11-12H2,1-2H3,(H,27,29)