N-(2H-1,3-benzothiazol-3-id-2-yl)-1-naphthalen-2-yl-ethanimine; ruthenium(3+)

Systemtic Name: N-(2H-1,3-benzothiazol-3-id-2-yl)-1-naphthalen-2-yl-ethanimine; ruthenium(3+) Openeye Name: N-(2H-1,3-benzothiazol-3-id-2-yl)-1-(2-naphthyl)ethanimine; ruthenium(3+) CAS Name: N-(2H-1,3-benzothiazol-3-id-2-yl)-1-(2-naphthalenyl)ethanimine; ruthenium(3+) IUPAC Name: N-(2H-1,3-benzothiazol-3-id-2-yl)-1-naphthalen-2-ylethanimine; ruthenium(3+) Traditional Name: (Z)-2H-1,3-benzothiazol-3-id-2-yl-[1-(2-naphthyl)ethylidene]amine; ruthenium(3+) Formula: C57H45N6RuS3 MolecularWeight: 1011.2724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1[N-]C2=CC=CC=C2S1)C3=CC4=CC=CC=C4C=C3.CC(=NC1[N-]C2=CC=CC=C2S1)C3=CC4=CC=CC=C4C=C3.CC(=NC1[N-]C2=CC=CC=C2S1)C3=CC4=CC=CC=C4C=C3.[Ru+3]

Isomeric SMILES

C/C(=N/C1SC2=CC=CC=C2[N-]1)/C3=CC4=CC=CC=C4C=C3.C/C(=N/C1SC2=CC=CC=C2[N-]1)/C3=CC4=CC=CC=C4C=C3.C/C(=N/C1SC2=CC=CC=C2[N-]1)/C3=CC4=CC=CC=C4C=C3.[Ru+3]

InChI

InChI=1S/3C19H15N2S.Ru/c3*1-13(15-11-10-14-6-2-3-7-16(14)12-15)20-19-21-17-8-4-5-9-18(17)22-19;/h3*2-12,19H,1H3;/q3*-1;+3/b3*20-13-;