1-[[(3Z)-3-(5-bromanyl-3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-phenyl-1,2-oxazolidin-5-yl]methyl]-3-ethyl-thiourea

Systemtic Name: 1-[[(3Z)-3-(5-bromanyl-3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-phenyl-1,2-oxazolidin-5-yl]methyl]-3-ethyl-thiourea Openeye Name: 1-[[(3Z)-3-(5-bromo-3-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-4-phenyl-isoxazolidin-5-yl]methyl]-3-ethyl-thiourea CAS Name: 1-[[(3Z)-3-(5-bromo-3-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-4-phenyl-5-isoxazolidinyl]methyl]-3-ethylthiourea IUPAC Name: 1-[[(3Z)-3-(5-bromo-3-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1,2-oxazolidin-5-yl]methyl]-3-ethylthiourea Traditional Name: 1-[[(3Z)-3-(5-bromo-3-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)-4-phenyl-isoxazolidin-5-yl]methyl]-3-ethyl-thiourea Formula: C19H20BrN3O3S MolecularWeight: 450.3494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1C(C(=C2C=C(C=C(C2=O)Br)O)NO1)C3=CC=CC=C3

Isomeric SMILES

CCNC(=S)NCC1C(/C(=C/2\C=C(C=C(C2=O)Br)O)/NO1)C3=CC=CC=C3

InChI

InChI=1S/C19H20BrN3O3S/c1-2-21-19(27)22-10-15-16(11-6-4-3-5-7-11)17(23-26-15)13-8-12(24)9-14(20)18(13)25/h3-9,15-16,23-24H,2,10H2,1H3,(H2,21,22,27)/b17-13-