1-pentyl-3-[(4-propan-2-ylphenyl)carbonylamino]thiourea

Systemtic Name: 1-pentyl-3-[(4-propan-2-ylphenyl)carbonylamino]thiourea Openeye Name: 1-[(4-isopropylbenzoyl)amino]-3-pentyl-thiourea CAS Name: 1-[[oxo-(4-propan-2-ylphenyl)methyl]amino]-3-pentylthiourea IUPAC Name: 1-pentyl-3-[(4-propan-2-ylbenzoyl)amino]thiourea Traditional Name: 1-amyl-3-(cumoylamino)thiourea Formula: C16H25N3OS MolecularWeight: 307.4542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)C(C)C

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)C(C)C

InChI

InChI=1S/C16H25N3OS/c1-4-5-6-11-17-16(21)19-18-15(20)14-9-7-13(8-10-14)12(2)3/h7-10,12H,4-6,11H2,1-3H3,(H,18,20)(H2,17,19,21)