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

Systemtic Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC4=C(CCCC4)C=C3C#N

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC4=C(CCCC4)C=C3C#N

InChI

InChI=1S/C21H20N4O2S2/c1-12(28-20-14(11-22)9-13-5-3-4-6-16(13)23-20)19(26)25-21-24-17-8-7-15(27-2)10-18(17)29-21/h7-10,12H,3-6H2,1-2H3,(H,24,25,26)