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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1=CC=CC=C1N2C=NN=N2

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C1=CC=CC=C1N2C=NN=N2

InChI

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