phenyl N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]carbamate

Systemtic Name: phenyl N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]carbamate Openeye Name: phenyl N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]carbamate CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]carbamate Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]carbamic acid phenyl ester Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(CNC(=O)OC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(CNC(=O)OC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C22H22N2O2S/c25-22(26-20-8-2-1-3-9-20)23-14-21(19-11-13-27-16-19)24-12-10-17-6-4-5-7-18(17)15-24/h1-9,11,13,16,21H,10,12,14-15H2,(H,23,25)