1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]thiourea

Systemtic Name: 1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]thiourea Openeye Name: 1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]thiourea CAS Name: 1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)-1-oxopropyl]amino]thiourea IUPAC Name: 1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]thiourea Traditional Name: 1-butyl-3-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]thiourea Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C(C)OC1=CC=CC(=C1C)C

Isomeric SMILES

CCCCNC(=S)NNC(=O)[C@H](C)OC1=CC=CC(=C1C)C

InChI

InChI=1S/C16H25N3O2S/c1-5-6-10-17-16(22)19-18-15(20)13(4)21-14-9-7-8-11(2)12(14)3/h7-9,13H,5-6,10H2,1-4H3,(H,18,20)(H2,17,19,22)/t13-/m0/s1