5-(2-isocyanatophenyl)-1-(2-methylpropyl)-2-methylsulfanyl-imidazole

Systemtic Name: 5-(2-isocyanatophenyl)-1-(2-methylpropyl)-2-methylsulfanyl-imidazole Openeye Name: 1-isobutyl-5-(2-isocyanatophenyl)-2-methylsulfanyl-imidazole CAS Name: 5-(2-isocyanatophenyl)-1-(2-methylpropyl)-2-(methylthio)imidazole IUPAC Name: 5-(2-isocyanatophenyl)-1-(2-methylpropyl)-2-methylsulfanylimidazole Traditional Name: 1-isobutyl-5-(2-isocyanatophenyl)-2-(methylthio)imidazole Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1SC)C2=CC=CC=C2N=C=O

Isomeric SMILES

CC(C)CN1C(=CN=C1SC)C2=CC=CC=C2N=C=O

InChI

InChI=1S/C15H17N3OS/c1-11(2)9-18-14(8-16-15(18)20-3)12-6-4-5-7-13(12)17-10-19/h4-8,11H,9H2,1-3H3