sodium 2-(1H-thieno[3,4-d]imidazol-2-ylsulfinylmethyl)aniline

Systemtic Name: sodium 2-(1H-thieno[3,4-d]imidazol-2-ylsulfinylmethyl)aniline Openeye Name: sodium 2-(1H-thieno[3,4-d]imidazol-2-ylsulfinylmethyl)aniline CAS Name: sodium 2-(1H-thieno[3,4-d]imidazol-2-ylsulfinylmethyl)aniline IUPAC Name: sodium 2-(1H-thieno[3,4-d]imidazol-2-ylsulfinylmethyl)aniline Traditional Name: sodium [2-(1H-thien[3,4-d]imidazol-2-ylsulfinylmethyl)phenyl]amine Formula: C12H11N3NaOS2+ MolecularWeight: 300.35501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CS(=O)C2=NC3=CSC=C3N2)N.[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)CS(=O)C2=NC3=CSC=C3N2)N.[Na+]

InChI

InChI=1S/C12H11N3OS2.Na/c13-9-4-2-1-3-8(9)7-18(16)12-14-10-5-17-6-11(10)15-12;/h1-6H,7,13H2,(H,14,15);/q;+1