1-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]-3-(4-isopropylphenyl)thiourea CAS Name: 1-[[(2S)-2-(2,3-dimethylphenoxy)-1-oxopropyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[[(2S)-2-(2,3-dimethylphenoxy)propanoyl]amino]-3-p-cumenyl-thiourea Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)O[C@@H](C)C(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C)C

InChI

InChI=1S/C21H27N3O2S/c1-13(2)17-9-11-18(12-10-17)22-21(27)24-23-20(25)16(5)26-19-8-6-7-14(3)15(19)4/h6-13,16H,1-5H3,(H,23,25)(H2,22,24,27)/t16-/m0/s1