2-[[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[[[4-(3-methylpiperidin-1-yl)sulfonylphenyl]amino]methylidene]propanedinitrile Openeye Name: 2-[[4-[(3-methyl-1-piperidyl)sulfonyl]anilino]methylene]propanedinitrile CAS Name: 2-[[4-[(3-methyl-1-piperidinyl)sulfonyl]anilino]methylidene]propanedinitrile IUPAC Name: 2-[[4-(3-methylpiperidin-1-yl)sulfonylanilino]methylidene]propanedinitrile Traditional Name: 2-[[4-(3-methylpiperidino)sulfonylanilino]methylene]malononitrile Formula: C16H18N4O2S MolecularWeight: 330.40472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC=C(C#N)C#N

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC=C(C#N)C#N

InChI

InChI=1S/C16H18N4O2S/c1-13-3-2-8-20(12-13)23(21,22)16-6-4-15(5-7-16)19-11-14(9-17)10-18/h4-7,11,13,19H,2-3,8,12H2,1H3