2-azido-4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazole

Systemtic Name: 2-azido-4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazole Openeye Name: 2-azido-4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanyl-imidazole CAS Name: 2-azido-4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-(phenylthio)imidazole IUPAC Name: 2-azido-4-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-phenylsulfanylimidazole Traditional Name: 2-azido-1-methyl-5-(phenylthio)-4-piperonyl-imidazole Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1N=[N+]=[N-])CC2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

Isomeric SMILES

CN1C(=C(N=C1N=[N+]=[N-])CC2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

InChI

InChI=1S/C18H15N5O2S/c1-23-17(26-13-5-3-2-4-6-13)14(20-18(23)21-22-19)9-12-7-8-15-16(10-12)25-11-24-15/h2-8,10H,9,11H2,1H3