1-[2-(2,3-dimethylphenoxy)ethanoylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[2-(2,3-dimethylphenoxy)ethanoylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[2-(2,3-dimethylphenoxy)acetyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[2-(2,3-dimethylphenoxy)-1-oxoethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[2-(2,3-dimethylphenoxy)acetyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[2-(2,3-dimethylphenoxy)acetyl]amino]-3-isoamyl-thiourea Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NNC(=S)NCCC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NNC(=S)NCCC(C)C)C

InChI

InChI=1S/C16H25N3O2S/c1-11(2)8-9-17-16(22)19-18-15(20)10-21-14-7-5-6-12(3)13(14)4/h5-7,11H,8-10H2,1-4H3,(H,18,20)(H2,17,19,22)