(phenylmethyl) N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate

Systemtic Name: (phenylmethyl) N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamate Openeye Name: benzyl N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate CAS Name: N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Traditional Name: N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid benzyl ester Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N2O3S/c25-21(20-7-4-12-28-20)24-11-10-17-8-9-19(13-18(17)14-24)23-22(26)27-15-16-5-2-1-3-6-16/h1-9,12-13H,10-11,14-15H2,(H,23,26)