N-[5-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[5-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide Openeye Name: N-[5-(morpholin-4-ium-4-ylmethyl)-4-phenyl-thiazol-2-yl]benzamide CAS Name: N-[5-(4-morpholin-4-iumylmethyl)-4-phenyl-2-thiazolyl]benzamide IUPAC Name: N-[5-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide Traditional Name: N-[5-(morpholin-4-ium-4-ylmethyl)-4-phenyl-thiazol-2-yl]benzamide Formula: C21H22N3O2S+ MolecularWeight: 380.48328

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CC2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c25-20(17-9-5-2-6-10-17)23-21-22-19(16-7-3-1-4-8-16)18(27-21)15-24-11-13-26-14-12-24/h1-10H,11-15H2,(H,22,23,25)/p+1