2-ethyl-5,6-bis(phenylsulfanyl)-1,3-benzoxazole-4,7-dione

Systemtic Name: 2-ethyl-5,6-bis(phenylsulfanyl)-1,3-benzoxazole-4,7-dione Openeye Name: 2-ethyl-5,6-bis(phenylsulfanyl)-1,3-benzoxazole-4,7-dione CAS Name: 2-ethyl-5,6-bis(phenylthio)-1,3-benzoxazole-4,7-dione IUPAC Name: 2-ethyl-5,6-bis(phenylsulfanyl)-1,3-benzoxazole-4,7-dione Traditional Name: 2-ethyl-5,6-bis(phenylthio)-1,3-benzoxazole-4,7-quinone Formula: C21H15NO3S2 MolecularWeight: 393.4787

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(O1)C(=O)C(=C(C2=O)SC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCC1=NC2=C(O1)C(=O)C(=C(C2=O)SC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H15NO3S2/c1-2-15-22-16-17(23)20(26-13-9-5-3-6-10-13)21(18(24)19(16)25-15)27-14-11-7-4-8-12-14/h3-12H,2H2,1H3