[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 4-azanyl-3-(cyclohexylcarbamoyl)-1,2-thiazole-5-carboxylate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 4-azanyl-3-(cyclohexylcarbamoyl)-1,2-thiazole-5-carboxylate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 4-amino-3-(cyclohexylcarbamoyl)isothiazole-5-carboxylate CAS Name: 4-amino-3-[(cyclohexylamino)-oxomethyl]-5-isothiazolecarboxylic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 4-amino-3-(cyclohexylcarbamoyl)-1,2-thiazole-5-carboxylate Traditional Name: 4-amino-3-(cyclohexylcarbamoyl)isothiazole-5-carboxylic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C19H28N4O4S MolecularWeight: 408.51502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)COC(=O)C2=C(C(=NS2)C(=O)NC3CCCCC3)N

Isomeric SMILES

C1CCC(CC1)NC(=O)COC(=O)C2=C(C(=NS2)C(=O)NC3CCCCC3)N

InChI

InChI=1S/C19H28N4O4S/c20-15-16(18(25)22-13-9-5-2-6-10-13)23-28-17(15)19(26)27-11-14(24)21-12-7-3-1-4-8-12/h12-13H,1-11,20H2,(H,21,24)(H,22,25)