N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[(4-chlorophenyl)-(1-methyl-2-imidazolyl)methyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C21H20ClN3OS2 MolecularWeight: 429.986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C21H20ClN3OS2/c1-25-11-10-23-19(25)18(14-6-8-17(22)9-7-14)24-20(26)15-2-4-16(5-3-15)21-27-12-13-28-21/h2-11,18,21H,12-13H2,1H3,(H,24,26)