5-azanyl-2-[(6-ethenyl-1,3-benzodioxol-5-yl)sulfanyl]-1-methyl-imidazole-4-carboxamide

Systemtic Name: 5-azanyl-2-[(6-ethenyl-1,3-benzodioxol-5-yl)sulfanyl]-1-methyl-imidazole-4-carboxamide Openeye Name: 5-amino-1-methyl-2-[(6-vinyl-1,3-benzodioxol-5-yl)sulfanyl]imidazole-4-carboxamide CAS Name: 5-amino-2-[(6-ethenyl-1,3-benzodioxol-5-yl)thio]-1-methyl-4-imidazolecarboxamide IUPAC Name: 5-amino-2-[(6-ethenyl-1,3-benzodioxol-5-yl)sulfanyl]-1-methylimidazole-4-carboxamide Traditional Name: 5-amino-1-methyl-2-[(6-vinyl-1,3-benzodioxol-5-yl)thio]imidazole-4-carboxamide Formula: C14H14N4O3S MolecularWeight: 318.35096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1SC2=CC3=C(C=C2C=C)OCO3)C(=O)N)N

Isomeric SMILES

CN1C(=C(N=C1SC2=CC3=C(C=C2C=C)OCO3)C(=O)N)N

InChI

InChI=1S/C14H14N4O3S/c1-3-7-4-8-9(21-6-20-8)5-10(7)22-14-17-11(13(16)19)12(15)18(14)2/h3-5H,1,6,15H2,2H3,(H2,16,19)