N-[1-(4-imidazol-1-ylphenyl)ethyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[1-[4-(1-imidazolyl)phenyl]ethyl]-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1,1-dioxothiolane-3-carboxamide Traditional Name: N-[1-(4-imidazol-1-ylphenyl)ethyl]-1,1-diketo-thiolane-3-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C16H19N3O3S/c1-12(18-16(20)14-6-9-23(21,22)10-14)13-2-4-15(5-3-13)19-8-7-17-11-19/h2-5,7-8,11-12,14H,6,9-10H2,1H3,(H,18,20)