2-tert-butyl-1-isoquinolin-1-yl-3-(1,3-thiazol-2-yl)guanidine

Systemtic Name: 2-tert-butyl-1-isoquinolin-1-yl-3-(1,3-thiazol-2-yl)guanidine Openeye Name: 2-tert-butyl-1-(1-isoquinolyl)-3-thiazol-2-yl-guanidine CAS Name: 2-tert-butyl-1-(1-isoquinolinyl)-3-(2-thiazolyl)guanidine IUPAC Name: 2-tert-butyl-1-isoquinolin-1-yl-3-(1,3-thiazol-2-yl)guanidine Traditional Name: 2-tert-butyl-1-(1-isoquinolyl)-3-thiazol-2-yl-guanidine Formula: C17H19N5S MolecularWeight: 325.43126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(NC1=NC=CC2=CC=CC=C21)NC3=NC=CS3

Isomeric SMILES

CC(C)(C)N=C(NC1=NC=CC2=CC=CC=C21)NC3=NC=CS3

InChI

InChI=1S/C17H19N5S/c1-17(2,3)22-15(21-16-19-10-11-23-16)20-14-13-7-5-4-6-12(13)8-9-18-14/h4-11H,1-3H3,(H2,18,19,20,21,22)