1-phenethyl-3-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-phenethyl-3-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-phenethyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea CAS Name: 1-[[oxo-[4-(1-tetrazolyl)phenyl]methyl]amino]-3-phenethylthiourea IUPAC Name: 1-phenethyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Traditional Name: 1-phenethyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Formula: C17H17N7OS MolecularWeight: 367.42818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C17H17N7OS/c25-16(14-6-8-15(9-7-14)24-12-19-22-23-24)20-21-17(26)18-11-10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,20,25)(H2,18,21,26)