[5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [5-(m-tolylsulfinylmethyl)-2-furyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [5-[(3-methylphenyl)sulfinylmethyl]-2-furanyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [5-[(3-methylphenyl)sulfinylmethyl]furan-2-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [5-(m-tolylsulfinylmethyl)-2-furyl]-[4-(2-pyridyl)piperazino]methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)CC2=CC=C(O2)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H23N3O3S/c1-17-5-4-6-19(15-17)29(27)16-18-8-9-20(28-18)22(26)25-13-11-24(12-14-25)21-7-2-3-10-23-21/h2-10,15H,11-14,16H2,1H3