dimethyl-[2-[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)ethanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)ethanoylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[2-(2-pyrrol-1-ylthiazol-4-yl)acetyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[1-oxo-2-[2-(1-pyrrolyl)-4-thiazolyl]ethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[2-(2-pyrrol-1-yl-1,3-thiazol-4-yl)acetyl]amino]ethyl]azanium Traditional Name: dimethyl-[2-[[2-(2-pyrrol-1-ylthiazol-4-yl)acetyl]amino]ethyl]ammonium Formula: C13H19N4OS+ MolecularWeight: 279.38116

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CC1=CSC(=N1)N2C=CC=C2

Isomeric SMILES

C[NH+](C)CCNC(=O)CC1=CSC(=N1)N2C=CC=C2

InChI

InChI=1S/C13H18N4OS/c1-16(2)8-5-14-12(18)9-11-10-19-13(15-11)17-6-3-4-7-17/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,14,18)/p+1