1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]propan-1-one Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C20H21N3O2S/c1-13(19(24)23-11-5-7-14-6-3-4-8-18(14)23)26-20-21-16-10-9-15(25-2)12-17(16)22-20/h3-4,6,8-10,12-13H,5,7,11H2,1-2H3,(H,21,22)