1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-[[(3-ethyl-5-methyl-4-isoxazolyl)-oxomethyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]-3-(4-fluorobenzyl)thiourea Formula: C15H17FN4O2S MolecularWeight: 336.384483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NNC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NNC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C15H17FN4O2S/c1-3-12-13(9(2)22-20-12)14(21)18-19-15(23)17-8-10-4-6-11(16)7-5-10/h4-7H,3,8H2,1-2H3,(H,18,21)(H2,17,19,23)