2-[(4-isothiocyanatophenyl)amino]-2-phenyl-indene-1,3-dione

Systemtic Name: 2-[(4-isothiocyanatophenyl)amino]-2-phenyl-indene-1,3-dione Openeye Name: 2-(4-isothiocyanatoanilino)-2-phenyl-indane-1,3-dione CAS Name: 2-(4-isothiocyanatoanilino)-2-phenylindene-1,3-dione IUPAC Name: 2-(4-isothiocyanatoanilino)-2-phenylindene-1,3-dione Traditional Name: 2-(4-isothiocyanatoanilino)-2-phenyl-indane-1,3-quinone Formula: C22H14N2O2S MolecularWeight: 370.42376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)N=C=S

Isomeric SMILES

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)N=C=S

InChI

InChI=1S/C22H14N2O2S/c25-20-18-8-4-5-9-19(18)21(26)22(20,15-6-2-1-3-7-15)24-17-12-10-16(11-13-17)23-14-27/h1-13,24H