1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfonyl]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfonyl]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyltetrazol-5-yl)methylsulfonyl]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyl-5-tetrazolyl)methylsulfonyl]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyltetrazol-5-yl)methylsulfonyl]ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-phenyltetrazol-5-yl)methylsulfonyl]ethanone Formula: C19H19N5O3S MolecularWeight: 397.45086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CS(=O)(=O)CC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CS(=O)(=O)CC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H19N5O3S/c25-19(23-11-10-15-6-4-5-7-16(15)12-23)14-28(26,27)13-18-20-21-22-24(18)17-8-2-1-3-9-17/h1-9H,10-14H2