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

Systemtic Name: 4-[(3-chloranyl-6-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methylpyridin-3-yl)piperazine-1-carboxamide Openeye Name: 4-[(3-chloro-6-methyl-benzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridyl)piperazine-1-carboxamide CAS Name: 4-[(3-chloro-6-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3-chloro-6-methyl-1-benzothiophen-2-yl)methyl]-N-(6-methylpyridin-3-yl)piperazine-1-carboxamide Traditional Name: 4-[(3-chloro-6-methyl-benzothiophen-2-yl)methyl]-N-(6-methyl-3-pyridyl)piperazine-1-carboxamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)CN3CCN(CC3)C(=O)NC4=CN=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)CN3CCN(CC3)C(=O)NC4=CN=C(C=C4)C)Cl

InChI

InChI=1S/C21H23ClN4OS/c1-14-3-6-17-18(11-14)28-19(20(17)22)13-25-7-9-26(10-8-25)21(27)24-16-5-4-15(2)23-12-16/h3-6,11-12H,7-10,13H2,1-2H3,(H,24,27)