3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Openeye Name: 3-[(5-chloro-2-methoxy-phenyl)methyl-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: 3-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide IUPAC Name: 3-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)-methyl-amino]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)CC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CN(CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N)CC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H24ClN3O2S/c1-25(13-14-11-15(22)7-8-18(14)27-2)10-9-20(26)24-21-17(12-23)16-5-3-4-6-19(16)28-21/h7-8,11H,3-6,9-10,13H2,1-2H3,(H,24,26)