2-(3,4-dimethoxyphenyl)sulfanyl-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(3,4-dimethoxyphenyl)sulfanyl-propan-1-one CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-1-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(3,4-dimethoxyphenyl)sulfanylpropan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-2-[(3,4-dimethoxyphenyl)thio]propan-1-one Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)SC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H32N2O3S/c1-21(34-24-14-15-25(32-2)26(20-24)33-3)28(31)30-18-16-29(17-19-30)27(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-15,20-21,27H,16-19H2,1-3H3