1-(3-ethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-ethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]carbonylamino]thiourea Openeye Name: 1-(3-ethylphenyl)-3-[(4-isopentyloxybenzoyl)amino]thiourea CAS Name: 1-(3-ethylphenyl)-3-[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-[[4-(3-methylbutoxy)benzoyl]amino]thiourea Traditional Name: 1-(3-ethylphenyl)-3-[(4-isoamoxybenzoyl)amino]thiourea Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C21H27N3O2S/c1-4-16-6-5-7-18(14-16)22-21(27)24-23-20(25)17-8-10-19(11-9-17)26-13-12-15(2)3/h5-11,14-15H,4,12-13H2,1-3H3,(H,23,25)(H2,22,24,27)