S-pentan-2-yl 2-chloranyl-4-(methylcarbamoylamino)benzenecarbothioate

Systemtic Name: S-pentan-2-yl 2-chloranyl-4-(methylcarbamoylamino)benzenecarbothioate Openeye Name: S-(1-methylbutyl) 2-chloro-4-(methylcarbamoylamino)benzenecarbothioate CAS Name: 2-chloro-4-(methylcarbamoylamino)benzenecarbothioic acid S-pentan-2-yl ester IUPAC Name: S-pentan-2-yl 2-chloro-4-(methylcarbamoylamino)benzenecarbothioate Traditional Name: 2-chloro-4-(methylcarbamoylamino)thiobenzoic acid S-(1-methylbutyl) ester Formula: C14H19ClN2O2S MolecularWeight: 314.83086

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)SC(=O)C1=C(C=C(C=C1)NC(=O)NC)Cl

Isomeric SMILES

CCCC(C)SC(=O)C1=C(C=C(C=C1)NC(=O)NC)Cl

InChI

InChI=1S/C14H19ClN2O2S/c1-4-5-9(2)20-13(18)11-7-6-10(8-12(11)15)17-14(19)16-3/h6-9H,4-5H2,1-3H3,(H2,16,17,19)