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

Systemtic Name: N-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[[5-(2-methylthiazol-4-yl)-2-thienyl]methyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[[5-(2-methyl-4-thiazolyl)-2-thiophenyl]methyl]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[[5-(2-methylthiazol-4-yl)-2-thienyl]methyl]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C21H24N3O2S2+ MolecularWeight: 414.56416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(S2)CNC(=O)C3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C21H23N3O2S2/c1-15-23-19(14-27-15)20-7-6-18(28-20)12-22-21(25)17-4-2-16(3-5-17)13-24-8-10-26-11-9-24/h2-7,14H,8-13H2,1H3,(H,22,25)/p+1