cyclopentyl 2-chloranyl-5-[(2-methylphenyl)carbothioylamino]benzoate

Systemtic Name: cyclopentyl 2-chloranyl-5-[(2-methylphenyl)carbothioylamino]benzoate Openeye Name: cyclopentyl 2-chloro-5-[(2-methylbenzenecarbothioyl)amino]benzoate CAS Name: 2-chloro-5-[[(2-methylphenyl)-sulfanylidenemethyl]amino]benzoic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-chloro-5-[(2-methylbenzenecarbothioyl)amino]benzoate Traditional Name: 2-chloro-5-[(2-methylthiobenzoyl)amino]benzoic acid cyclopentyl ester Formula: C20H20ClNO2S MolecularWeight: 373.8963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3

InChI

InChI=1S/C20H20ClNO2S/c1-13-6-2-5-9-16(13)19(25)22-14-10-11-18(21)17(12-14)20(23)24-15-7-3-4-8-15/h2,5-6,9-12,15H,3-4,7-8H2,1H3,(H,22,25)