N-[[4-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[[1,1-bis(oxidanylidene)thiolan-3-yl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[(1,1-dioxothiolan-3-yl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[(1,1-dioxo-3-thiolanyl)amino]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[(1,1-dioxothiolan-3-yl)carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[(1,1-diketothiolan-3-yl)carbamoyl]benzyl]adamantane-1-carboxamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30N2O4S/c26-21(25-20-5-6-30(28,29)14-20)19-3-1-15(2-4-19)13-24-22(27)23-10-16-7-17(11-23)9-18(8-16)12-23/h1-4,16-18,20H,5-14H2,(H,24,27)(H,25,26)