isoquinolin-5-ylmethyl-methyl-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]azanium

Systemtic Name: isoquinolin-5-ylmethyl-methyl-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]azanium Openeye Name: 5-isoquinolylmethyl-methyl-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]ammonium CAS Name: 5-isoquinolinylmethyl-methyl-[[5-methyl-2-(3-thiophenyl)-4-oxazolyl]methyl]ammonium IUPAC Name: isoquinolin-5-ylmethyl-methyl-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]azanium Traditional Name: 5-isoquinolylmethyl-methyl-[[5-methyl-2-(3-thienyl)oxazol-4-yl]methyl]ammonium Formula: C20H20N3OS+ MolecularWeight: 350.4573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CSC=C2)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CSC=C2)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H19N3OS/c1-14-19(22-20(24-14)17-7-9-25-13-17)12-23(2)11-16-5-3-4-15-10-21-8-6-18(15)16/h3-10,13H,11-12H2,1-2H3/p+1