(1,4,5-triphenylbenzimidazol-2-yl)methanethiol

Systemtic Name: (1,4,5-triphenylbenzimidazol-2-yl)methanethiol Openeye Name: (1,4,5-triphenylbenzimidazol-2-yl)methanethiol CAS Name: (1,4,5-triphenyl-2-benzimidazolyl)methanethiol IUPAC Name: (1,4,5-triphenylbenzimidazol-2-yl)methanethiol Traditional Name: (1,4,5-triphenylbenzimidazol-2-yl)methanethiol Formula: C26H20N2S MolecularWeight: 392.5154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=C(C=C2)N(C(=N3)CS)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=C(C=C2)N(C(=N3)CS)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H20N2S/c29-18-24-27-26-23(28(24)21-14-8-3-9-15-21)17-16-22(19-10-4-1-5-11-19)25(26)20-12-6-2-7-13-20/h1-17,29H,18H2