3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one

Systemtic Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one Openeye Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-(5-methylbenzothiophen-3-yl)propan-1-one CAS Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-1-(5-methyl-1-benzothiophen-3-yl)-1-propanone IUPAC Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one Traditional Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]-1-(5-methylbenzothiophen-3-yl)propan-1-one Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC=C2C(=O)CCN3CCN(CC3)C4=C5C(=CC=C4)OCCO5

Isomeric SMILES

CC1=CC2=C(C=C1)SC=C2C(=O)CCN3CCN(CC3)C4=C5C(=CC=C4)OCCO5

InChI

InChI=1S/C24H26N2O3S/c1-17-5-6-23-18(15-17)19(16-30-23)21(27)7-8-25-9-11-26(12-10-25)20-3-2-4-22-24(20)29-14-13-28-22/h2-6,15-16H,7-14H2,1H3