S-cyclohexyl 2-chloranyl-4-isocyanato-benzenecarbothioate

Systemtic Name: S-cyclohexyl 2-chloranyl-4-isocyanato-benzenecarbothioate Openeye Name: S-cyclohexyl 2-chloro-4-isocyanato-benzenecarbothioate CAS Name: 2-chloro-4-isocyanatobenzenecarbothioic acid S-cyclohexyl ester IUPAC Name: S-cyclohexyl 2-chloro-4-isocyanatobenzenecarbothioate Traditional Name: 2-chloro-4-isocyanato-thiobenzoic acid S-cyclohexyl ester Formula: C14H14ClNO2S MolecularWeight: 295.78446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC(=O)C2=C(C=C(C=C2)N=C=O)Cl

Isomeric SMILES

C1CCC(CC1)SC(=O)C2=C(C=C(C=C2)N=C=O)Cl

InChI

InChI=1S/C14H14ClNO2S/c15-13-8-10(16-9-17)6-7-12(13)14(18)19-11-4-2-1-3-5-11/h6-8,11H,1-5H2