1,3-bis(thiophen-2-ylmethyl)-1,3-diazinane-1,3-diium-5-carbonitrile

Systemtic Name: 1,3-bis(thiophen-2-ylmethyl)-1,3-diazinane-1,3-diium-5-carbonitrile Openeye Name: 1,3-bis(2-thienylmethyl)hexahydropyrimidine-1,3-diium-5-carbonitrile CAS Name: 1,3-bis(thiophen-2-ylmethyl)-1,3-diazinane-1,3-diium-5-carbonitrile IUPAC Name: 1,3-bis(thiophen-2-ylmethyl)-1,3-diazinane-1,3-diium-5-carbonitrile Traditional Name: 1,3-bis(2-thenyl)hexahydropyrimidine-1,3-diium-5-carbonitrile Formula: C15H19N3S2+2 MolecularWeight: 305.46146

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH+](C[NH+]1CC2=CC=CS2)CC3=CC=CS3)C#N

Isomeric SMILES

C1C(C[NH+](C[NH+]1CC2=CC=CS2)CC3=CC=CS3)C#N

InChI

InChI=1S/C15H17N3S2/c16-7-13-8-17(10-14-3-1-5-19-14)12-18(9-13)11-15-4-2-6-20-15/h1-6,13H,8-12H2/p+2