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

Systemtic Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-phenylpyridin-3-yl)piperazine-1-carboxamide Openeye Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(6-phenyl-3-pyridyl)piperazine-1-carboxamide CAS Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-phenyl-3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-phenylpyridin-3-yl)piperazine-1-carboxamide Traditional Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(6-phenyl-3-pyridyl)piperazine-1-carboxamide Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)CN3CCN(CC3)C(=O)NC4=CN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)CN3CCN(CC3)C(=O)NC4=CN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4OS/c1-19-22-9-5-6-10-24(22)32-25(19)18-29-13-15-30(16-14-29)26(31)28-21-11-12-23(27-17-21)20-7-3-2-4-8-20/h2-12,17H,13-16,18H2,1H3,(H,28,31)