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

Systemtic Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methylpyridin-3-yl)piperazine-1-carboxamide Openeye Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridyl)piperazine-1-carboxamide CAS Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methylpyridin-3-yl)piperazine-1-carboxamide Traditional Name: 4-[(3-methylbenzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridyl)piperazine-1-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)NC(=O)N2CCN(CC2)CC3=C(C4=CC=CC=C4S3)C

Isomeric SMILES

CC1=NC=C(C=C1)NC(=O)N2CCN(CC2)CC3=C(C4=CC=CC=C4S3)C

InChI

InChI=1S/C21H24N4OS/c1-15-7-8-17(13-22-15)23-21(26)25-11-9-24(10-12-25)14-20-16(2)18-5-3-4-6-19(18)27-20/h3-8,13H,9-12,14H2,1-2H3,(H,23,26)