1-[2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethanoylamino]-3-phenyl-urea

Systemtic Name: 1-[2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethanoylamino]-3-phenyl-urea Openeye Name: 1-[[2-(1H-benzimidazol-3-ium-2-ylsulfanyl)acetyl]amino]-3-phenyl-urea CAS Name: 1-[[2-(1H-benzimidazol-3-ium-2-ylthio)-1-oxoethyl]amino]-3-phenylurea IUPAC Name: 1-[[2-(1H-benzimidazol-3-ium-2-ylsulfanyl)acetyl]amino]-3-phenylurea Traditional Name: 1-[[2-(1H-benzimidazol-3-ium-2-ylthio)acetyl]amino]-3-phenyl-urea Formula: C16H16N5O2S+ MolecularWeight: 342.39554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NNC(=O)CSC2=[NH+]C3=CC=CC=C3N2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NNC(=O)CSC2=[NH+]C3=CC=CC=C3N2

InChI

InChI=1S/C16H15N5O2S/c22-14(20-21-15(23)17-11-6-2-1-3-7-11)10-24-16-18-12-8-4-5-9-13(12)19-16/h1-9H,10H2,(H,18,19)(H,20,22)(H2,17,21,23)/p+1