1-(2-fluorophenyl)-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea

Systemtic Name: 1-(2-fluorophenyl)-3-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiourea Openeye Name: 1-(2-fluorophenyl)-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea CAS Name: 1-(2-fluorophenyl)-3-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiourea Traditional Name: 1-(2-fluorophenyl)-3-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]thiourea Formula: C18H17FN4O3S MolecularWeight: 388.415983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NNC(=O)CCCN2C3=CC=CC=C3OC2=O)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NNC(=O)CCCN2C3=CC=CC=C3OC2=O)F

InChI

InChI=1S/C18H17FN4O3S/c19-12-6-1-2-7-13(12)20-17(27)22-21-16(24)10-5-11-23-14-8-3-4-9-15(14)26-18(23)25/h1-4,6-9H,5,10-11H2,(H,21,24)(H2,20,22,27)