1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrrol-1-ylthiazol-5-yl)ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(1-pyrrolyl)-5-thiazolyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrrol-1-yl-1,3-thiazol-5-yl)ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-pyrrol-1-ylthiazol-5-yl)ethanone Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CC3=CN=C(S3)N4C=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CC3=CN=C(S3)N4C=CC=C4

InChI

InChI=1S/C18H17N3OS/c22-17(21-10-7-14-5-1-2-6-15(14)13-21)11-16-12-19-18(23-16)20-8-3-4-9-20/h1-6,8-9,12H,7,10-11,13H2