4-[[2-[[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]phenyl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]phenyl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[2-[[(1R)-3-oxo-1H-isobenzofuran-1-yl]amino]phenyl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[2-[[(1R)-3-oxo-1H-isobenzofuran-1-yl]amino]phenyl]thio]methyl]benzonitrile IUPAC Name: 4-[[2-[[(1R)-3-oxo-1H-2-benzofuran-1-yl]amino]phenyl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[2-[[(1R)-3-ketophthalan-1-yl]amino]phenyl]thio]methyl]benzonitrile Formula: C22H16N2O2S MolecularWeight: 372.43964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)[C@@H](OC2=O)NC3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H16N2O2S/c23-13-15-9-11-16(12-10-15)14-27-20-8-4-3-7-19(20)24-21-17-5-1-2-6-18(17)22(25)26-21/h1-12,21,24H,14H2/t21-/m1/s1