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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]propanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]propanamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]propanamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]propanamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]propionamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)OC

InChI

InChI=1S/C23H29N3O3S/c1-4-29-19-10-9-16(13-20(19)28-3)15-26(2)12-11-22(27)25-23-18(14-24)17-7-5-6-8-21(17)30-23/h9-10,13H,4-8,11-12,15H2,1-3H3,(H,25,27)