(2-acetamido-1,3-thiazol-4-yl)methyl-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Openeye Name: (2-acetamidothiazol-4-yl)methyl-ethyl-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: (2-acetamido-4-thiazolyl)methyl-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl-ethyl-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: (2-acetamidothiazol-4-yl)methyl-ethyl-[3-methoxy-4-(2-thenyloxy)benzyl]ammonium Formula: C21H26N3O3S2+ MolecularWeight: 432.57944

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)CC3=CSC(=N3)NC(=O)C

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)CC3=CSC(=N3)NC(=O)C

InChI

InChI=1S/C21H25N3O3S2/c1-4-24(12-17-14-29-21(23-17)22-15(2)25)11-16-7-8-19(20(10-16)26-3)27-13-18-6-5-9-28-18/h5-10,14H,4,11-13H2,1-3H3,(H,22,23,25)/p+1