[5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[5-(m-tolylsulfinylmethyl)-2-furyl]methanone CAS Name: [5-[(3-methylphenyl)sulfinylmethyl]-2-furanyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]methanone Traditional Name: (4-benzylpiperazino)-[5-(m-tolylsulfinylmethyl)-2-furyl]methanone Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

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