N-(cyclopropylcarbamoyl)-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamide

Systemtic Name: N-(cyclopropylcarbamoyl)-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamide Openeye Name: N-(cyclopropylcarbamoyl)-2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-[(cyclopropylamino)-oxomethyl]-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide IUPAC Name: N-(cyclopropylcarbamoyl)-2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide Traditional Name: N-(cyclopropylcarbamoyl)-2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC(=O)NC3CC3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC(=O)NC3CC3)C4=CC=CS4)OC

InChI

InChI=1S/C21H25N3O4S/c1-27-16-10-13-7-8-24(12-19(25)23-21(26)22-14-5-6-14)20(18-4-3-9-29-18)15(13)11-17(16)28-2/h3-4,9-11,14,20H,5-8,12H2,1-2H3,(H2,22,23,25,26)