2-[5-(azetidin-1-ylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]propanedinitrile

Systemtic Name: 2-[5-(azetidin-1-ylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]propanedinitrile Openeye Name: 2-[5-(azetidin-1-ylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxo-indolin-3-ylidene]propanedinitrile CAS Name: 2-[5-(1-azetidinylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxo-3-indolylidene]propanedinitrile IUPAC Name: 2-[5-(azetidin-1-ylsulfonyl)-1-[(4-methoxyphenyl)methyl]-2-oxoindol-3-ylidene]propanedinitrile Traditional Name: 2-[5-(azetidin-1-ylsulfonyl)-2-keto-1-p-anisyl-indolin-3-ylidene]malononitrile Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC4)C(=C(C#N)C#N)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC4)C(=C(C#N)C#N)C2=O

InChI

InChI=1S/C22H18N4O4S/c1-30-17-5-3-15(4-6-17)14-26-20-8-7-18(31(28,29)25-9-2-10-25)11-19(20)21(22(26)27)16(12-23)13-24/h3-8,11H,2,9-10,14H2,1H3