1-[2-(3-bromanylphenoxy)ethanoylamino]-3-(3,5-dimethylphenyl)thiourea

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethanoylamino]-3-(3,5-dimethylphenyl)thiourea Openeye Name: 1-[[2-(3-bromophenoxy)acetyl]amino]-3-(3,5-dimethylphenyl)thiourea CAS Name: 1-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-3-(3,5-dimethylphenyl)thiourea IUPAC Name: 1-[[2-(3-bromophenoxy)acetyl]amino]-3-(3,5-dimethylphenyl)thiourea Traditional Name: 1-[[2-(3-bromophenoxy)acetyl]amino]-3-(3,5-dimethylphenyl)thiourea Formula: C17H18BrN3O2S MolecularWeight: 408.31272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C17H18BrN3O2S/c1-11-6-12(2)8-14(7-11)19-17(24)21-20-16(22)10-23-15-5-3-4-13(18)9-15/h3-9H,10H2,1-2H3,(H,20,22)(H2,19,21,24)