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

Systemtic Name: 1-[[3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanoyl]amino]-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-[[3-phenyl-2-(tetrazol-1-yl)propanoyl]amino]thiourea CAS Name: 1-[[1-oxo-3-phenyl-2-(1-tetrazolyl)propyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[3-phenyl-2-(tetrazol-1-yl)propanoyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[[3-phenyl-2-(tetrazol-1-yl)propanoyl]amino]thiourea Formula: C14H19N7OS MolecularWeight: 333.41196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C(CC1=CC=CC=C1)N2C=NN=N2

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C(CC1=CC=CC=C1)N2C=NN=N2

InChI

InChI=1S/C14H19N7OS/c1-10(2)16-14(23)18-17-13(22)12(21-9-15-19-20-21)8-11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3,(H,17,22)(H2,16,18,23)