5-[[2-(naphthalen-2-ylmethyl)-1,3-benzoxazol-5-yl]methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one

Systemtic Name: 5-[[2-(naphthalen-2-ylmethyl)-1,3-benzoxazol-5-yl]methyl]-2-oxidanylidene-1,2,3-thiadiazolidin-2-ium-4-one Openeye Name: 5-[[2-(2-naphthylmethyl)-1,3-benzoxazol-5-yl]methyl]-2-oxo-thiadiazolidin-2-ium-4-one CAS Name: 5-[[2-(2-naphthalenylmethyl)-1,3-benzoxazol-5-yl]methyl]-2-oxo-4-thiadiazolidin-2-iumone IUPAC Name: 5-[[2-(naphthalen-2-ylmethyl)-1,3-benzoxazol-5-yl]methyl]-2-oxothiadiazolidin-2-ium-4-one Traditional Name: 2-keto-5-[[2-(2-naphthylmethyl)-1,3-benzoxazol-5-yl]methyl]thiadiazolidin-2-ium-4-one Formula: C21H16N3O3S+ MolecularWeight: 390.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC3=NC4=C(O3)C=CC(=C4)CC5C(=O)N[N+](=O)S5

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC3=NC4=C(O3)C=CC(=C4)CC5C(=O)N[N+](=O)S5

InChI

InChI=1S/C21H15N3O3S/c25-21-19(28-24(26)23-21)11-14-6-8-18-17(10-14)22-20(27-18)12-13-5-7-15-3-1-2-4-16(15)9-13/h1-10,19H,11-12H2/p+1