1-(2,4-dimethylphenyl)-3-(3-phenylpropanoylamino)thiourea

Systemtic Name: 1-(2,4-dimethylphenyl)-3-(3-phenylpropanoylamino)thiourea Openeye Name: 1-(2,4-dimethylphenyl)-3-(3-phenylpropanoylamino)thiourea CAS Name: 1-(2,4-dimethylphenyl)-3-[(1-oxo-3-phenylpropyl)amino]thiourea IUPAC Name: 1-(2,4-dimethylphenyl)-3-(3-phenylpropanoylamino)thiourea Traditional Name: 1-(2,4-dimethylphenyl)-3-(hydrocinnamoylamino)thiourea Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NNC(=O)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NNC(=O)CCC2=CC=CC=C2)C

InChI

InChI=1S/C18H21N3OS/c1-13-8-10-16(14(2)12-13)19-18(23)21-20-17(22)11-9-15-6-4-3-5-7-15/h3-8,10,12H,9,11H2,1-2H3,(H,20,22)(H2,19,21,23)