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

Systemtic Name: 1-(4-methoxyphenyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-(4-methoxyphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Formula: C17H17N7O2S MolecularWeight: 383.42758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N7O2S/c1-26-14-9-7-13(8-10-14)18-17(27)21-19-15(25)11-24-22-16(20-23-24)12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,25)(H2,18,21,27)