N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[(1-methyl-2-imidazolyl)-phenylmethyl]-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[(1-methylimidazol-2-yl)-phenylmethyl]-1,1-dioxothiolane-3-carboxamide Traditional Name: 1,1-diketo-N-[(1-methylimidazol-2-yl)-phenyl-methyl]thiolane-3-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3CCS(=O)(=O)C3

InChI

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