N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-yl-ethyl]-N-(2-dimethylaminoethyl)ethanediamide

Systemtic Name: N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-yl-ethyl]-N-(2-dimethylaminoethyl)ethanediamide Openeye Name: N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-thienyl)ethyl]-N-(2-dimethylaminoethyl)oxamide CAS Name: N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethyl]-N-(2-dimethylaminoethyl)oxamide IUPAC Name: N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-2-ylethyl]-N-(2-dimethylaminoethyl)oxamide Traditional Name: N'-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-thienyl)ethyl]-N-(2-dimethylaminoethyl)oxamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C(=O)NCC(C1=CC=CS1)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN(C)CCNC(=O)C(=O)NC[C@H](C1=CC=CS1)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H28N4O2S/c1-24(2)12-10-22-20(26)21(27)23-14-18(19-8-5-13-28-19)25-11-9-16-6-3-4-7-17(16)15-25/h3-8,13,18H,9-12,14-15H2,1-2H3,(H,22,26)(H,23,27)/t18-/m1/s1