N-butyl-5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-amine

Systemtic Name: N-butyl-5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-amine Openeye Name: N-butyl-5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-amine CAS Name: N-butyl-5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-amine IUPAC Name: N-butyl-5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-amine Traditional Name: butyl-[5-(4-methoxyphenyl)-3-methyl-4H-1,3,4-thiadiazin-3-ium-2-yl]amine Formula: C15H22N3OS+ MolecularWeight: 292.41968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=[N+](NC(=CS1)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CCCCNC1=[N+](NC(=CS1)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C15H21N3OS/c1-4-5-10-16-15-18(2)17-14(11-20-15)12-6-8-13(19-3)9-7-12/h6-9,11,17H,4-5,10H2,1-3H3/p+1