4-[[6-(2,4-dimethylphenyl)sulfonyl-4,5-dimethyl-3-oxidanylidene-pyrazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[6-(2,4-dimethylphenyl)sulfonyl-4,5-dimethyl-3-oxidanylidene-pyrazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[6-(2,4-dimethylphenyl)sulfonyl-4,5-dimethyl-3-oxo-pyrazin-2-yl]amino]benzonitrile CAS Name: 4-[[6-(2,4-dimethylphenyl)sulfonyl-4,5-dimethyl-3-oxo-2-pyrazinyl]amino]benzonitrile IUPAC Name: 4-[[6-(2,4-dimethylphenyl)sulfonyl-4,5-dimethyl-3-oxopyrazin-2-yl]amino]benzonitrile Traditional Name: 4-[[6-(2,4-dimethylphenyl)sulfonyl-3-keto-4,5-dimethyl-pyrazin-2-yl]amino]benzonitrile Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)C2=C(N(C(=O)C(=N2)NC3=CC=C(C=C3)C#N)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)C2=C(N(C(=O)C(=N2)NC3=CC=C(C=C3)C#N)C)C)C

InChI

InChI=1S/C21H20N4O3S/c1-13-5-10-18(14(2)11-13)29(27,28)20-15(3)25(4)21(26)19(24-20)23-17-8-6-16(12-22)7-9-17/h5-11H,1-4H3,(H,23,24)