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

Systemtic Name: 1-prop-2-enyl-3-[[4-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-allyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea CAS Name: 1-[[oxo-[4-(1-tetrazolyl)phenyl]methyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-prop-2-enyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Traditional Name: 1-allyl-3-[[4-(tetrazol-1-yl)benzoyl]amino]thiourea Formula: C12H13N7OS MolecularWeight: 303.34292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N7OS/c1-2-7-13-12(21)16-15-11(20)9-3-5-10(6-4-9)19-8-14-17-18-19/h2-6,8H,1,7H2,(H,15,20)(H2,13,16,21)