bis[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: bis[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: bis[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-[(1S)-1,2-dimethylpropyl]ammonium CAS Name: bis[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: bis[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: bis[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-[(1S)-1,2-dimethylpropyl]ammonium Formula: C19H22N5O2S2+ MolecularWeight: 416.54028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)[NH+](CC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

C[C@@H](C(C)C)[NH+](CC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C19H21N5O2S2/c1-12(2)13(3)24(10-16(25)22-18-14(8-20)4-6-27-18)11-17(26)23-19-15(9-21)5-7-28-19/h4-7,12-13H,10-11H2,1-3H3,(H,22,25)(H,23,26)/p+1/t13-/m0/s1