4-[[2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenecarbonitrile Openeye Name: 4-[[3,4-dioxo-2-[[(1S)-1,2,2-trimethylpropyl]amino]cyclobuten-1-yl]amino]benzonitrile CAS Name: 4-[[2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-3,4-dioxo-1-cyclobutenyl]amino]benzonitrile IUPAC Name: 4-[[2-[[(2S)-3,3-dimethylbutan-2-yl]amino]-3,4-dioxocyclobuten-1-yl]amino]benzonitrile Traditional Name: 4-[[3,4-diketo-2-[[(1S)-1,2,2-trimethylpropyl]amino]cyclobuten-1-yl]amino]benzonitrile Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@@H](C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H19N3O2/c1-10(17(2,3)4)19-13-14(16(22)15(13)21)20-12-7-5-11(9-18)6-8-12/h5-8,10,19-20H,1-4H3/t10-/m0/s1