2-[(3-chloranyl-2-methyl-phenyl)amino]-2-(3-methyl-5-methylsulfanyl-furan-2-yl)ethanoic acid

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)amino]-2-(3-methyl-5-methylsulfanyl-furan-2-yl)ethanoic acid Openeye Name: 2-(3-chloro-2-methyl-anilino)-2-(3-methyl-5-methylsulfanyl-2-furyl)acetic acid CAS Name: 2-(3-chloro-2-methylanilino)-2-[3-methyl-5-(methylthio)-2-furanyl]acetic acid IUPAC Name: 2-(3-chloro-2-methylanilino)-2-(3-methyl-5-methylsulfanylfuran-2-yl)acetic acid Traditional Name: 2-(3-chloro-2-methyl-anilino)-2-[3-methyl-5-(methylthio)-2-furyl]acetic acid Formula: C15H16ClNO3S MolecularWeight: 325.81044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)SC)C(C(=O)O)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CC1=C(OC(=C1)SC)C(C(=O)O)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C15H16ClNO3S/c1-8-7-12(21-3)20-14(8)13(15(18)19)17-11-6-4-5-10(16)9(11)2/h4-7,13,17H,1-3H3,(H,18,19)