N-[4-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C22H25ClN2O2S/c1-15-19(23)8-5-9-20(15)25-21(26)14-28-18-12-10-17(11-13-18)24-22(27)16-6-3-2-4-7-16/h5,8-13,16H,2-4,6-7,14H2,1H3,(H,24,27)(H,25,26)