2-(4-cyclohexylphenoxy)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-cyclohexylphenoxy)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-cyclohexylphenoxy)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-cyclohexylphenoxy)-N-[[4-(4-morpholin-4-iumylmethyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-cyclohexylphenoxy)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-cyclohexylphenoxy)-N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]thiocarbamoyl]acetamide Formula: C26H34N3O3S+ MolecularWeight: 468.63146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NC3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C26H33N3O3S/c30-25(19-32-24-12-8-22(9-13-24)21-4-2-1-3-5-21)28-26(33)27-23-10-6-20(7-11-23)18-29-14-16-31-17-15-29/h6-13,21H,1-5,14-19H2,(H2,27,28,30,33)/p+1