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

Systemtic Name: 1-(3-ethylphenyl)-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-(3-ethylphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea CAS Name: 1-(3-ethylphenyl)-3-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-(3-ethylphenyl)-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Formula: C18H19N7OS MolecularWeight: 381.45476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H19N7OS/c1-2-13-7-6-10-15(11-13)19-18(27)22-20-16(26)12-25-23-17(21-24-25)14-8-4-3-5-9-14/h3-11H,2,12H2,1H3,(H,20,26)(H2,19,22,27)