N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2,3-dimethoxyphenyl)methyl-methylamino]acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2,3-dimethoxyphenyl)methyl-methylamino]acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[methyl(o-veratryl)amino]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CN(CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C21H25N3O3S/c1-24(12-14-7-6-9-17(26-2)20(14)27-3)13-19(25)23-21-16(11-22)15-8-4-5-10-18(15)28-21/h6-7,9H,4-5,8,10,12-13H2,1-3H3,(H,23,25)