3-(2,2-dimethylthiomorpholin-4-yl)-1-methylsulfonyl-indole-5-carbonitrile

Systemtic Name: 3-(2,2-dimethylthiomorpholin-4-yl)-1-methylsulfonyl-indole-5-carbonitrile Openeye Name: 3-(2,2-dimethylthiomorpholin-4-yl)-1-methylsulfonyl-indole-5-carbonitrile CAS Name: 3-(2,2-dimethyl-4-thiomorpholinyl)-1-methylsulfonyl-5-indolecarbonitrile IUPAC Name: 3-(2,2-dimethylthiomorpholin-4-yl)-1-methylsulfonylindole-5-carbonitrile Traditional Name: 3-(2,2-dimethylthiomorpholin-4-yl)-1-mesyl-indole-5-carbonitrile Formula: C16H19N3O2S2 MolecularWeight: 349.47096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCS1)C2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C)C

Isomeric SMILES

CC1(CN(CCS1)C2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C)C

InChI

InChI=1S/C16H19N3O2S2/c1-16(2)11-18(6-7-22-16)15-10-19(23(3,20)21)14-5-4-12(9-17)8-13(14)15/h4-5,8,10H,6-7,11H2,1-3H3