2-(4-isothiocyanatophenyl)-3-phenyl-inden-1-one

Systemtic Name: 2-(4-isothiocyanatophenyl)-3-phenyl-inden-1-one Openeye Name: 2-(4-isothiocyanatophenyl)-3-phenyl-inden-1-one CAS Name: 2-(4-isothiocyanatophenyl)-3-phenyl-1-indenone IUPAC Name: 2-(4-isothiocyanatophenyl)-3-phenylinden-1-one Traditional Name: 2-(4-isothiocyanatophenyl)-3-phenyl-inden-1-one Formula: C22H13NOS MolecularWeight: 339.40972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N=C=S

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)N=C=S

InChI

InChI=1S/C22H13NOS/c24-22-19-9-5-4-8-18(19)20(15-6-2-1-3-7-15)21(22)16-10-12-17(13-11-16)23-14-25/h1-13H