1-[[2,5-bis(oxidanyl)phenyl]carbonylamino]-3-(3-ethanoylphenyl)thiourea

Systemtic Name: 1-[[2,5-bis(oxidanyl)phenyl]carbonylamino]-3-(3-ethanoylphenyl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-[(2,5-dihydroxybenzoyl)amino]thiourea CAS Name: 1-(3-acetylphenyl)-3-[[(2,5-dihydroxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[(2,5-dihydroxybenzoyl)amino]thiourea Traditional Name: 1-(3-acetylphenyl)-3-(gentisoylamino)thiourea Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NNC(=O)C2=C(C=CC(=C2)O)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NNC(=O)C2=C(C=CC(=C2)O)O

InChI

InChI=1S/C16H15N3O4S/c1-9(20)10-3-2-4-11(7-10)17-16(24)19-18-15(23)13-8-12(21)5-6-14(13)22/h2-8,21-22H,1H3,(H,18,23)(H2,17,19,24)