(4R)-6-oxidanylidene-N-[(4-phenylphenyl)methyl]-1,2-dithia-5-azacycloundecane-4-carboxamide

Systemtic Name: (4R)-6-oxidanylidene-N-[(4-phenylphenyl)methyl]-1,2-dithia-5-azacycloundecane-4-carboxamide Openeye Name: (4R)-6-oxo-N-[(4-phenylphenyl)methyl]-1,2-dithia-5-azacycloundecane-4-carboxamide CAS Name: (4R)-6-oxo-N-[(4-phenylphenyl)methyl]-1,2-dithia-5-azacycloundecane-4-carboxamide IUPAC Name: (4R)-6-oxo-N-[(4-phenylphenyl)methyl]-1,2-dithia-5-azacycloundecane-4-carboxamide Traditional Name: (4R)-6-keto-N-(4-phenylbenzyl)-1,2-dithia-5-azacycloundecane-4-carboxamide Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(CSSCC1)C(=O)NCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)N[C@@H](CSSCC1)C(=O)NCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2S2/c25-21-9-5-2-6-14-27-28-16-20(24-21)22(26)23-15-17-10-12-19(13-11-17)18-7-3-1-4-8-18/h1,3-4,7-8,10-13,20H,2,5-6,9,14-16H2,(H,23,26)(H,24,25)/t20-/m0/s1