1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanone

Systemtic Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanone Openeye Name: 2-[allyl(2-thienylmethyl)amino]-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanone IUPAC Name: 1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanone Traditional Name: 2-[allyl(2-thenyl)amino]-1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CN(CC=C)CC3=CC=CS3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CN(CC=C)CC3=CC=CS3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H30N2O3S/c1-4-13-28(18-22-11-8-15-33-22)19-26(30)29-14-12-21-16-24(31-2)25(32-3)17-23(21)27(29)20-9-6-5-7-10-20/h4-11,15-17,27H,1,12-14,18-19H2,2-3H3