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

Systemtic Name: cyclopentyl 2-chloranyl-5-[(2-methoxyphenyl)carbothioylamino]benzoate Openeye Name: cyclopentyl 2-chloro-5-[(2-methoxybenzenecarbothioyl)amino]benzoate CAS Name: 2-chloro-5-[[(2-methoxyphenyl)-sulfanylidenemethyl]amino]benzoic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-chloro-5-[(2-methoxybenzenecarbothioyl)amino]benzoate Traditional Name: 2-chloro-5-[(2-methoxythiobenzoyl)amino]benzoic acid cyclopentyl ester Formula: C20H20ClNO3S MolecularWeight: 389.8957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3

Isomeric SMILES

COC1=CC=CC=C1C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3

InChI

InChI=1S/C20H20ClNO3S/c1-24-18-9-5-4-8-15(18)19(26)22-13-10-11-17(21)16(12-13)20(23)25-14-6-2-3-7-14/h4-5,8-12,14H,2-3,6-7H2,1H3,(H,22,26)