3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethyl]benzamide

Systemtic Name: 3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethyl]benzamide Openeye Name: 3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethyl]benzamide CAS Name: 3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)thio]ethyl]benzamide IUPAC Name: 3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethyl]benzamide Traditional Name: 3-methyl-4-nitro-N-[2-[(5-phenyl-1H-imidazol-2-yl)thio]ethyl]benzamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCSC2=NC=C(N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCSC2=NC=C(N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3S/c1-13-11-15(7-8-17(13)23(25)26)18(24)20-9-10-27-19-21-12-16(22-19)14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H,20,24)(H,21,22)