3-methyl-N-[4-[2-(2-morpholin-4-ium-4-ylethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-(2-morpholin-4-ium-4-ylethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-(2-morpholin-4-ium-4-ylethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[2-[2-(4-morpholin-4-iumyl)ethylamino]-6H-1,3,4-thiadiazin-5-yl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-(2-morpholin-4-ium-4-ylethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]butanamide Traditional Name: 3-methyl-N-[4-[2-(2-morpholin-4-ium-4-ylethylamino)-6H-1,3,4-thiadiazin-5-yl]phenyl]butyramide Formula: C20H30N5O2S+ MolecularWeight: 404.5495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NN=C(SC2)NCC[NH+]3CCOCC3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NN=C(SC2)NCC[NH+]3CCOCC3

InChI

InChI=1S/C20H29N5O2S/c1-15(2)13-19(26)22-17-5-3-16(4-6-17)18-14-28-20(24-23-18)21-7-8-25-9-11-27-12-10-25/h3-6,15H,7-14H2,1-2H3,(H,21,24)(H,22,26)/p+1