4-[4-[4-(3,4-dimethoxyphenyl)sulfanylbutyl]piperazin-1-yl]-1H-indole

Systemtic Name: 4-[4-[4-(3,4-dimethoxyphenyl)sulfanylbutyl]piperazin-1-yl]-1H-indole Openeye Name: 4-[4-[4-(3,4-dimethoxyphenyl)sulfanylbutyl]piperazin-1-yl]-1H-indole CAS Name: 4-[4-[4-[(3,4-dimethoxyphenyl)thio]butyl]-1-piperazinyl]-1H-indole IUPAC Name: 4-[4-[4-(3,4-dimethoxyphenyl)sulfanylbutyl]piperazin-1-yl]-1H-indole Traditional Name: 4-[4-[4-[(3,4-dimethoxyphenyl)thio]butyl]piperazino]-1H-indole Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCCCCN2CCN(CC2)C3=CC=CC4=C3C=CN4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCCCCN2CCN(CC2)C3=CC=CC4=C3C=CN4)OC

InChI

InChI=1S/C24H31N3O2S/c1-28-23-9-8-19(18-24(23)29-2)30-17-4-3-12-26-13-15-27(16-14-26)22-7-5-6-21-20(22)10-11-25-21/h5-11,18,25H,3-4,12-17H2,1-2H3