4-[(6-ethoxy-3-methyl-1-benzothiophen-2-yl)methyl]-N-pyridin-3-yl-piperazine-1-carboxamide

Systemtic Name: 4-[(6-ethoxy-3-methyl-1-benzothiophen-2-yl)methyl]-N-pyridin-3-yl-piperazine-1-carboxamide Openeye Name: 4-[(6-ethoxy-3-methyl-benzothiophen-2-yl)methyl]-N-(3-pyridyl)piperazine-1-carboxamide CAS Name: 4-[(6-ethoxy-3-methyl-1-benzothiophen-2-yl)methyl]-N-(3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-[(6-ethoxy-3-methyl-1-benzothiophen-2-yl)methyl]-N-pyridin-3-ylpiperazine-1-carboxamide Traditional Name: 4-[(6-ethoxy-3-methyl-benzothiophen-2-yl)methyl]-N-(3-pyridyl)piperazine-1-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=C(S2)CN3CCN(CC3)C(=O)NC4=CN=CC=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=C(S2)CN3CCN(CC3)C(=O)NC4=CN=CC=C4)C

InChI

InChI=1S/C22H26N4O2S/c1-3-28-18-6-7-19-16(2)21(29-20(19)13-18)15-25-9-11-26(12-10-25)22(27)24-17-5-4-8-23-14-17/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,24,27)