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

Systemtic Name: 1-ethyl-3-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-ethyl-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea CAS Name: 1-ethyl-3-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-ethyl-3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiourea Formula: C12H15N7OS MolecularWeight: 305.3588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N7OS/c1-2-13-12(21)16-14-10(20)8-19-17-11(15-18-19)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,14,20)(H2,13,16,21)