4-ethanoyl-3,5-dimethyl-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-3,5-dimethyl-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-3,5-dimethyl-N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-3,5-dimethyl-N-[4-(4-morpholin-4-iumylmethyl)-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-3,5-dimethyl-N-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-3,5-dimethyl-N-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C17H23N4O3S+ MolecularWeight: 363.45452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NC(=CS2)C[NH+]3CCOCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)NC2=NC(=CS2)C[NH+]3CCOCC3

InChI

InChI=1S/C17H22N4O3S/c1-10-14(12(3)22)11(2)18-15(10)16(23)20-17-19-13(9-25-17)8-21-4-6-24-7-5-21/h9,18H,4-8H2,1-3H3,(H,19,20,23)/p+1