2-[2-oxidanylidene-1-(phenylmethyl)-5-thiomorpholin-4-ylsulfonyl-indol-3-ylidene]propanedinitrile

Systemtic Name: 2-[2-oxidanylidene-1-(phenylmethyl)-5-thiomorpholin-4-ylsulfonyl-indol-3-ylidene]propanedinitrile Openeye Name: 2-(1-benzyl-2-oxo-5-thiomorpholinosulfonyl-indolin-3-ylidene)propanedinitrile CAS Name: 2-[2-oxo-1-(phenylmethyl)-5-thiomorpholin-4-ylsulfonyl-3-indolylidene]propanedinitrile IUPAC Name: 2-(1-benzyl-2-oxo-5-thiomorpholin-4-ylsulfonylindol-3-ylidene)propanedinitrile Traditional Name: 2-(1-benzyl-2-keto-5-thiomorpholinosulfonyl-indolin-3-ylidene)malononitrile Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=C(C#N)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CSCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=C(C#N)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3S2/c23-13-17(14-24)21-19-12-18(31(28,29)25-8-10-30-11-9-25)6-7-20(19)26(22(21)27)15-16-4-2-1-3-5-16/h1-7,12H,8-11,15H2