1-[[4-[(6-methoxy-1-benzothiophen-2-yl)sulfonyl]-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazine

Systemtic Name: 1-[[4-[(6-methoxy-1-benzothiophen-2-yl)sulfonyl]-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazine Openeye Name: 1-[[4-(6-methoxybenzothiophen-2-yl)sulfonyl-1-(4-pyridyl)-4-piperidyl]methyl]piperazine CAS Name: 1-[[4-[(6-methoxy-1-benzothiophen-2-yl)sulfonyl]-1-pyridin-4-yl-4-piperidinyl]methyl]piperazine IUPAC Name: 1-[[4-[(6-methoxy-1-benzothiophen-2-yl)sulfonyl]-1-pyridin-4-ylpiperidin-4-yl]methyl]piperazine Traditional Name: 1-[[4-(6-methoxybenzothiophen-2-yl)sulfonyl-1-(4-pyridyl)-4-piperidyl]methyl]piperazine Formula: C24H30N4O3S2 MolecularWeight: 486.65

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(S2)S(=O)(=O)C3(CCN(CC3)C4=CC=NC=C4)CN5CCNCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(S2)S(=O)(=O)C3(CCN(CC3)C4=CC=NC=C4)CN5CCNCC5

InChI

InChI=1S/C24H30N4O3S2/c1-31-21-3-2-19-16-23(32-22(19)17-21)33(29,30)24(18-27-14-10-26-11-15-27)6-12-28(13-7-24)20-4-8-25-9-5-20/h2-5,8-9,16-17,26H,6-7,10-15,18H2,1H3