N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H22N4O2S/c1-14-19(20(26-28-14)15-8-4-3-5-9-15)22(27)25-18(12-13-29-2)21-23-16-10-6-7-11-17(16)24-21/h3-11,18H,12-13H2,1-2H3,(H,23,24)(H,25,27)