pentyl 2-[(2-chloranyl-4-methyl-phenyl)carbamothioylamino]ethanoate

Systemtic Name: pentyl 2-[(2-chloranyl-4-methyl-phenyl)carbamothioylamino]ethanoate Openeye Name: pentyl 2-[(2-chloro-4-methyl-phenyl)carbamothioylamino]acetate CAS Name: 2-[[(2-chloro-4-methylanilino)-sulfanylidenemethyl]amino]acetic acid pentyl ester IUPAC Name: pentyl 2-[(2-chloro-4-methylphenyl)carbamothioylamino]acetate Traditional Name: 2-[(2-chloro-4-methyl-phenyl)thiocarbamoylamino]acetic acid amyl ester Formula: C15H21ClN2O2S MolecularWeight: 328.85744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CNC(=S)NC1=C(C=C(C=C1)C)Cl

Isomeric SMILES

CCCCCOC(=O)CNC(=S)NC1=C(C=C(C=C1)C)Cl

InChI

InChI=1S/C15H21ClN2O2S/c1-3-4-5-8-20-14(19)10-17-15(21)18-13-7-6-11(2)9-12(13)16/h6-7,9H,3-5,8,10H2,1-2H3,(H2,17,18,21)