2-[1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)ethanamide Openeye Name: N-(3-nitrophenyl)-2-[1-(p-tolylmethyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: 2-[[1-[(4-methylphenyl)methyl]-2-imidazolyl]thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)acetamide Traditional Name: 2-[[1-(4-methylbenzyl)imidazol-2-yl]thio]-N-(3-nitrophenyl)acetamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CN=C2SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CN=C2SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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