1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol

Systemtic Name: 1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol Openeye Name: 1-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol CAS Name: 1-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-3-[(3,4-dimethoxyphenyl)methoxy]-2-propanol IUPAC Name: 1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol Traditional Name: 1-[4-(benzothiophen-3-ylmethyl)piperazino]-3-veratryloxy-propan-2-ol Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COCC(CN2CCN(CC2)CC3=CSC4=CC=CC=C43)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)COCC(CN2CCN(CC2)CC3=CSC4=CC=CC=C43)O)OC

InChI

InChI=1S/C25H32N2O4S/c1-29-23-8-7-19(13-24(23)30-2)16-31-17-21(28)15-27-11-9-26(10-12-27)14-20-18-32-25-6-4-3-5-22(20)25/h3-8,13,18,21,28H,9-12,14-17H2,1-2H3