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

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[1-oxo-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H21N5O2S/c1-13-8-9-16(12-14(13)2)21-20(28)24-23-17(26)10-11-18-22-19(25-27-18)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,23,26)(H2,21,24,28)