1-(4-chlorophenyl)-3-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[3-(2-keto-1,3-benzoxazol-3-yl)propanoylamino]thiourea Formula: C17H15ClN4O3S MolecularWeight: 390.844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN4O3S/c18-11-5-7-12(8-6-11)19-16(26)21-20-15(23)9-10-22-13-3-1-2-4-14(13)25-17(22)24/h1-8H,9-10H2,(H,20,23)(H2,19,21,26)