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

Systemtic Name: 1-propyl-3-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-propyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea CAS Name: 1-[[oxo-[4-(1-tetrazolyl)phenyl]methyl]amino]-3-propylthiourea IUPAC Name: 1-propyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Traditional Name: 1-propyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Formula: C12H15N7OS MolecularWeight: 305.3588

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NNC(=O)C1=CC=C(C=C1)N2C=NN=N2

Isomeric SMILES

CCCNC(=S)NNC(=O)C1=CC=C(C=C1)N2C=NN=N2

InChI

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