N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[3-[(4-fluorophenyl)thio]-5-nitrophenyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitrophenyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[3-[(4-fluorophenyl)thio]-5-nitro-phenyl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propionamide Formula: C22H16FN3O4S2 MolecularWeight: 469.508543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)O2)CCC(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)O2)CCC(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C22H16FN3O4S2/c23-14-5-7-17(8-6-14)32-18-12-15(11-16(13-18)26(28)29)24-21(27)9-10-25-19-3-1-2-4-20(19)30-22(25)31/h1-8,11-13H,9-10H2,(H,24,27)