1-[2,5-bis(oxidanyl)phenyl]-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea

Systemtic Name: 1-[2,5-bis(oxidanyl)phenyl]-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea Openeye Name: 1-(2,5-dihydroxyphenyl)-3-(2-thioxo-3H-1,3-benzothiazol-6-yl)urea CAS Name: 1-(2,5-dihydroxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea IUPAC Name: 1-(2,5-dihydroxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea Traditional Name: 1-(2,5-dihydroxyphenyl)-3-(2-thioxo-3H-1,3-benzothiazol-6-yl)urea Formula: C14H11N3O3S2 MolecularWeight: 333.38544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)NC3=C(C=CC(=C3)O)O)SC(=S)N2

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)NC3=C(C=CC(=C3)O)O)SC(=S)N2

InChI

InChI=1S/C14H11N3O3S2/c18-8-2-4-11(19)10(6-8)16-13(20)15-7-1-3-9-12(5-7)22-14(21)17-9/h1-6,18-19H,(H,17,21)(H2,15,16,20)