N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-thiolane-3-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-thiolane-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylamino)-2-oxo-ethyl]-5-oxo-tetrahydrothiophene-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylamino)-2-oxoethyl]-5-oxo-3-thiolanecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-N-[2-(cyclohexylamino)-2-oxoethyl]-5-oxothiolane-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-N-[2-(cyclohexylamino)-2-keto-ethyl]-5-keto-tetrahydrothiophene-3-carboxamide Formula: C20H25ClN2O3S MolecularWeight: 408.9421

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2Cl)C(=O)C3CC(=O)SC3

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(CC2=CC=CC=C2Cl)C(=O)C3CC(=O)SC3

InChI

InChI=1S/C20H25ClN2O3S/c21-17-9-5-4-6-14(17)11-23(20(26)15-10-19(25)27-13-15)12-18(24)22-16-7-2-1-3-8-16/h4-6,9,15-16H,1-3,7-8,10-13H2,(H,22,24)