2-nitro-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4-(phenylmethyl)phenolate

Systemtic Name: 2-nitro-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4-(phenylmethyl)phenolate Openeye Name: 4-benzyl-2-nitro-6-[(E)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenolate CAS Name: 2-nitro-6-[(E)-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-4-(phenylmethyl)phenolate IUPAC Name: 4-benzyl-2-nitro-6-[(E)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Traditional Name: 4-benzyl-2-[(E)-(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Formula: C17H11N2O4S2- MolecularWeight: 371.41024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(C(=C2)C=C3C(=O)NC(=S)S3)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(C(=C2)/C=C/3\C(=O)NC(=S)S3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O4S2/c20-15-12(9-14-16(21)18-17(24)25-14)7-11(8-13(15)19(22)23)6-10-4-2-1-3-5-10/h1-5,7-9,20H,6H2,(H,18,21,24)/p-1/b14-9+