N-tert-butyl-5-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-1-ium-3-ylidene]-4H-1,3,4-thiadiazin-2-amine

Systemtic Name: N-tert-butyl-5-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-1-ium-3-ylidene]-4H-1,3,4-thiadiazin-2-amine Openeye Name: N-tert-butyl-5-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-1-ium-3-ylidene]-4H-1,3,4-thiadiazin-2-amine CAS Name: N-tert-butyl-5-[2,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-3-pyrrol-1-iumylidene]-4H-1,3,4-thiadiazin-2-amine IUPAC Name: N-tert-butyl-5-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-1-ium-3-ylidene]-4H-1,3,4-thiadiazin-2-amine Traditional Name: tert-butyl-[5-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-1-ium-3-ylidene]-4H-1,3,4-thiadiazin-2-yl]amine Formula: C18H29N4OS+ MolecularWeight: 349.51406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CSC(=NN2)NC(C)(C)C)C(=[N+]1CC3CCCO3)C

Isomeric SMILES

CC1=CC(=C2CSC(=NN2)NC(C)(C)C)C(=[N+]1C[C@H]3CCCO3)C

InChI

InChI=1S/C18H28N4OS/c1-12-9-15(13(2)22(12)10-14-7-6-8-23-14)16-11-24-17(21-20-16)19-18(3,4)5/h9,14H,6-8,10-11H2,1-5H3,(H,19,21)/p+1/t14-/m1/s1