carbonic acid; N1-(5-chloranylthiophen-2-yl)-N3-phenethyl-cyclohexane-1,3-dicarboxamide

Systemtic Name: carbonic acid; N1-(5-chloranylthiophen-2-yl)-N3-phenethyl-cyclohexane-1,3-dicarboxamide Openeye Name: carbonic acid; N1-(5-chloro-2-thienyl)-N3-phenethyl-cyclohexane-1,3-dicarboxamide CAS Name: carbonic acid; N1-(5-chloro-2-thiophenyl)-N3-phenethylcyclohexane-1,3-dicarboxamide IUPAC Name: carbonic acid; 1-N-(5-chlorothiophen-2-yl)-3-N-phenethylcyclohexane-1,3-dicarboxamide Traditional Name: carbonic acid; N-(5-chloro-2-thienyl)-N'-phenethyl-cyclohexane-1,3-dicarboxamide Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)C(=O)NC2=CC=C(S2)Cl)C(=O)NCCC3=CC=CC=C3.C(=O)(O)O

Isomeric SMILES

C1CC(CC(C1)C(=O)NC2=CC=C(S2)Cl)C(=O)NCCC3=CC=CC=C3.C(=O)(O)O

InChI

InChI=1S/C20H23ClN2O2S.CH2O3/c21-17-9-10-18(26-17)23-20(25)16-8-4-7-15(13-16)19(24)22-12-11-14-5-2-1-3-6-14;2-1(3)4/h1-3,5-6,9-10,15-16H,4,7-8,11-13H2,(H,22,24)(H,23,25);(H2,2,3,4)