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

Systemtic Name: 4-ethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: 4-ethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: 4-ethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: 4-ethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: 4-ethyl-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C20H27N4O3S+ MolecularWeight: 403.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)CC(=O)NC3=NC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC[NH+]2CCOCC2)CC(=O)NC3=NC=CS3

InChI

InChI=1S/C20H26N4O3S/c1-2-16-3-5-17(6-4-16)19(26)24(9-8-23-10-12-27-13-11-23)15-18(25)22-20-21-7-14-28-20/h3-7,14H,2,8-13,15H2,1H3,(H,21,22,25)/p+1