N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]butyramide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC4=C(CC(CC4)C)C=C3C#N

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC4=C(CC(CC4)C)C=C3C#N

InChI

InChI=1S/C22H22N4OS2/c1-3-18(20(27)26-22-25-17-6-4-5-7-19(17)29-22)28-21-15(12-23)11-14-10-13(2)8-9-16(14)24-21/h4-7,11,13,18H,3,8-10H2,1-2H3,(H,25,26,27)