1-[[2-(imidazol-1-ylmethyl)-4,5-dihydro-1-benzothiophen-6-yl]methyl]-1-oxidanyl-urea

Systemtic Name: 1-[[2-(imidazol-1-ylmethyl)-4,5-dihydro-1-benzothiophen-6-yl]methyl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[[2-(imidazol-1-ylmethyl)-4,5-dihydrobenzothiophen-6-yl]methyl]urea CAS Name: 1-hydroxy-1-[[2-(1-imidazolylmethyl)-4,5-dihydro-1-benzothiophen-6-yl]methyl]urea IUPAC Name: 1-hydroxy-1-[[2-(imidazol-1-ylmethyl)-4,5-dihydro-1-benzothiophen-6-yl]methyl]urea Traditional Name: 1-hydroxy-1-[[2-(imidazol-1-ylmethyl)-4,5-dihydrobenzothiophen-6-yl]methyl]urea Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1CN(C(=O)N)O)SC(=C2)CN3C=CN=C3

Isomeric SMILES

C1CC2=C(C=C1CN(C(=O)N)O)SC(=C2)CN3C=CN=C3

InChI

InChI=1S/C14H16N4O2S/c15-14(19)18(20)7-10-1-2-11-6-12(21-13(11)5-10)8-17-4-3-16-9-17/h3-6,9,20H,1-2,7-8H2,(H2,15,19)