1-(2-ethyl-6-methyl-phenyl)-3-[[(2S)-2-(4-methylphenyl)sulfanylpropanoyl]amino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(2S)-2-(4-methylphenyl)sulfanylpropanoyl]amino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(2S)-2-(p-tolylsulfanyl)propanoyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[(2S)-2-[(4-methylphenyl)thio]-1-oxopropyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[(2S)-2-(4-methylphenyl)sulfanylpropanoyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[(2S)-2-(p-tolylthio)propanoyl]amino]thiourea Formula: C20H25N3OS2 MolecularWeight: 387.562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C(C)SC2=CC=C(C=C2)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)[C@H](C)SC2=CC=C(C=C2)C)C

InChI

InChI=1S/C20H25N3OS2/c1-5-16-8-6-7-14(3)18(16)21-20(25)23-22-19(24)15(4)26-17-11-9-13(2)10-12-17/h6-12,15H,5H2,1-4H3,(H,22,24)(H2,21,23,25)/t15-/m0/s1