1-(3-methylbutyl)-3-[(3-phenoxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(3-phenoxyphenyl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[(3-phenoxybenzoyl)amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[oxo-(3-phenoxyphenyl)methyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(3-phenoxybenzoyl)amino]thiourea Traditional Name: 1-isoamyl-3-[(3-phenoxybenzoyl)amino]thiourea Formula: C19H23N3O2S MolecularWeight: 357.46982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O2S/c1-14(2)11-12-20-19(25)22-21-18(23)15-7-6-10-17(13-15)24-16-8-4-3-5-9-16/h3-10,13-14H,11-12H2,1-2H3,(H,21,23)(H2,20,22,25)