1-[3-(1-benzothiophen-3-yl)propyl]-4-(5-chloranyl-3-methoxy-pyridin-2-yl)-2-methyl-piperazine

Systemtic Name: 1-[3-(1-benzothiophen-3-yl)propyl]-4-(5-chloranyl-3-methoxy-pyridin-2-yl)-2-methyl-piperazine Openeye Name: 1-[3-(benzothiophen-3-yl)propyl]-4-(5-chloro-3-methoxy-2-pyridyl)-2-methyl-piperazine CAS Name: 1-[3-(1-benzothiophen-3-yl)propyl]-4-(5-chloro-3-methoxy-2-pyridinyl)-2-methylpiperazine IUPAC Name: 1-[3-(1-benzothiophen-3-yl)propyl]-4-(5-chloro-3-methoxypyridin-2-yl)-2-methylpiperazine Traditional Name: 1-[3-(benzothiophen-3-yl)propyl]-4-(5-chloro-3-methoxy-2-pyridyl)-2-methyl-piperazine Formula: C22H26ClN3OS MolecularWeight: 415.97934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCCC2=CSC3=CC=CC=C32)C4=NC=C(C=C4OC)Cl

Isomeric SMILES

CC1CN(CCN1CCCC2=CSC3=CC=CC=C32)C4=NC=C(C=C4OC)Cl

InChI

InChI=1S/C22H26ClN3OS/c1-16-14-26(22-20(27-2)12-18(23)13-24-22)11-10-25(16)9-5-6-17-15-28-21-8-4-3-7-19(17)21/h3-4,7-8,12-13,15-16H,5-6,9-11,14H2,1-2H3