O-cyclohexyl N-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]carbamothioate

Systemtic Name: O-cyclohexyl N-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl]carbamothioate Openeye Name: O-cyclohexyl N-[(Z)-C-phenyl-N-(p-tolylsulfonyl)carbonimidoyl]carbamothioate CAS Name: N-[(Z)-(4-methylphenyl)sulfonylimino-phenylmethyl]carbamothioic acid O-cyclohexyl ester IUPAC Name: O-cyclohexyl N-[(Z)-N-(4-methylphenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioate Traditional Name: N-[(Z)-C-phenyl-N-tosyl-carbonimidoyl]thiocarbamic acid O-cyclohexyl ester Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)NC(=S)OC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(/C2=CC=CC=C2)\NC(=S)OC3CCCCC3

InChI

InChI=1S/C21H24N2O3S2/c1-16-12-14-19(15-13-16)28(24,25)23-20(17-8-4-2-5-9-17)22-21(27)26-18-10-6-3-7-11-18/h2,4-5,8-9,12-15,18H,3,6-7,10-11H2,1H3,(H,22,23,27)