4-[[5-chloranyl-4-methyl-2-[(5-methylfuran-2-yl)sulfanyl-propan-2-yl-amino]phenoxy]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[5-chloranyl-4-methyl-2-[(5-methylfuran-2-yl)sulfanyl-propan-2-yl-amino]phenoxy]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[5-chloro-2-[isopropyl-[(5-methyl-2-furyl)sulfanyl]amino]-4-methyl-phenoxy]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[5-chloro-4-methyl-2-[[(5-methyl-2-furanyl)thio]-propan-2-ylamino]phenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[5-chloro-4-methyl-2-[(5-methylfuran-2-yl)sulfanyl-propan-2-ylamino]phenoxy]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[5-chloro-2-[isopropyl-[(5-methyl-2-furyl)thio]amino]-4-methyl-phenoxy]methyl]-3-methoxy-benzoic acid Formula: C24H26ClNO5S MolecularWeight: 475.98494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)SN(C2=C(C=C(C(=C2)C)Cl)OCC3=C(C=C(C=C3)C(=O)O)OC)C(C)C

Isomeric SMILES

CC1=CC=C(O1)SN(C2=C(C=C(C(=C2)C)Cl)OCC3=C(C=C(C=C3)C(=O)O)OC)C(C)C

InChI

InChI=1S/C24H26ClNO5S/c1-14(2)26(32-23-9-6-16(4)31-23)20-10-15(3)19(25)12-22(20)30-13-18-8-7-17(24(27)28)11-21(18)29-5/h6-12,14H,13H2,1-5H3,(H,27,28)