1-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea CAS Name: 1-[[1-oxo-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-p-cumenyl-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2S/c1-14(2)15-8-10-17(11-9-15)22-21(29)25-24-18(27)12-13-19-23-20(26-28-19)16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3,(H,24,27)(H2,22,25,29)