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

Systemtic Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-pyridin-3-yl-piperazine-1-carboxamide Openeye Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(3-pyridyl)piperazine-1-carboxamide CAS Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-pyridin-3-ylpiperazine-1-carboxamide Traditional Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(3-pyridyl)piperazine-1-carboxamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4OS/c1-15-17-6-2-3-7-18(17)26-19(15)14-23-9-11-24(12-10-23)20(25)22-16-5-4-8-21-13-16/h2-8,13H,9-12,14H2,1H3,(H,22,25)