1-(2,3-dimethylphenyl)-3-(3-phenylsulfanylpropanoylamino)thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-(3-phenylsulfanylpropanoylamino)thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-(3-phenylsulfanylpropanoylamino)thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[1-oxo-3-(phenylthio)propyl]amino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-(3-phenylsulfanylpropanoylamino)thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[3-(phenylthio)propanoylamino]thiourea Formula: C18H21N3OS2 MolecularWeight: 359.50884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCSC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCSC2=CC=CC=C2)C

InChI

InChI=1S/C18H21N3OS2/c1-13-7-6-10-16(14(13)2)19-18(23)21-20-17(22)11-12-24-15-8-4-3-5-9-15/h3-10H,11-12H2,1-2H3,(H,20,22)(H2,19,21,23)