3-(3-morpholin-4-ium-4-ylpropyl)-N-(phenylmethyl)-4-thiophen-2-yl-1,3-thiazol-2-imine

Systemtic Name: 3-(3-morpholin-4-ium-4-ylpropyl)-N-(phenylmethyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Openeye Name: N-benzyl-3-(3-morpholin-4-ium-4-ylpropyl)-4-(2-thienyl)thiazol-2-imine CAS Name: 3-[3-(4-morpholin-4-iumyl)propyl]-N-(phenylmethyl)-4-thiophen-2-yl-2-thiazolimine IUPAC Name: N-benzyl-3-(3-morpholin-4-ium-4-ylpropyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Traditional Name: benzyl-[3-(3-morpholin-4-ium-4-ylpropyl)-4-(2-thienyl)-4-thiazolin-2-ylidene]amine Formula: C21H26N3OS2+ MolecularWeight: 400.58064

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=CSC2=NCC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=CSC2=NCC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H25N3OS2/c1-2-6-18(7-3-1)16-22-21-24(10-5-9-23-11-13-25-14-12-23)19(17-27-21)20-8-4-15-26-20/h1-4,6-8,15,17H,5,9-14,16H2/p+1