1-(2-methoxyethyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea CAS Name: 1-(2-methoxyethyl)-3-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-(2-methoxyethyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Formula: C13H17N7O2S MolecularWeight: 335.38478

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NNC(=O)CN1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

COCCNC(=S)NNC(=O)CN1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H17N7O2S/c1-22-8-7-14-13(23)17-15-11(21)9-20-18-12(16-19-20)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,15,21)(H2,14,17,23)