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

Systemtic Name: N-[4-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]phenyl]-2-phenyl-benzamide Openeye Name: N-[4-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]phenyl]-2-phenyl-benzamide CAS Name: N-[4-[4-(4-morpholin-4-iumylmethyl)-2-thiazolyl]phenyl]-2-phenylbenzamide IUPAC Name: N-[4-[4-(morpholin-4-ium-4-ylmethyl)-1,3-thiazol-2-yl]phenyl]-2-phenylbenzamide Traditional Name: N-[4-[4-(morpholin-4-ium-4-ylmethyl)thiazol-2-yl]phenyl]-2-phenyl-benzamide Formula: C27H26N3O2S+ MolecularWeight: 456.57924

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CSC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CC2=CSC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c31-26(25-9-5-4-8-24(25)20-6-2-1-3-7-20)28-22-12-10-21(11-13-22)27-29-23(19-33-27)18-30-14-16-32-17-15-30/h1-13,19H,14-18H2,(H,28,31)/p+1