1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]ethanone Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

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