N-(3-methyl-1,2-oxazol-5-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-[1-(m-tolyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[[1-(3-methylphenyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylpropanamide Traditional Name: N-(3-methylisoxazol-5-yl)-2-[[1-(m-tolyl)imidazol-2-yl]thio]propionamide Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SC(C)C(=O)NC3=CC(=NO3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SC(C)C(=O)NC3=CC(=NO3)C

InChI

InChI=1S/C17H18N4O2S/c1-11-5-4-6-14(9-11)21-8-7-18-17(21)24-13(3)16(22)19-15-10-12(2)20-23-15/h4-10,13H,1-3H3,(H,19,22)