N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]heptanamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]heptanamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]heptanamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-[2-oxo-2-(2-thiazolylamino)ethyl]heptanamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]heptanamide Traditional Name: N-[2-keto-2-(thiazol-2-ylamino)ethyl]-N-(2-morpholin-4-ium-4-ylethyl)enanthamide Formula: C18H31N4O3S+ MolecularWeight: 383.52874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N(CC[NH+]1CCOCC1)CC(=O)NC2=NC=CS2

Isomeric SMILES

CCCCCCC(=O)N(CC[NH+]1CCOCC1)CC(=O)NC2=NC=CS2

InChI

InChI=1S/C18H30N4O3S/c1-2-3-4-5-6-17(24)22(9-8-21-10-12-25-13-11-21)15-16(23)20-18-19-7-14-26-18/h7,14H,2-6,8-13,15H2,1H3,(H,19,20,23)/p+1