tert-butyl 2-chloranyl-5-[(2-methylfuran-3-yl)carbothioylamino]benzoate

Systemtic Name: tert-butyl 2-chloranyl-5-[(2-methylfuran-3-yl)carbothioylamino]benzoate Openeye Name: tert-butyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate CAS Name: 2-chloro-5-[[(2-methyl-3-furanyl)-sulfanylidenemethyl]amino]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate Traditional Name: 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoic acid tert-butyl ester Formula: C17H18ClNO3S MolecularWeight: 351.84772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H18ClNO3S/c1-10-12(7-8-21-10)15(23)19-11-5-6-14(18)13(9-11)16(20)22-17(2,3)4/h5-9H,1-4H3,(H,19,23)