2-tert-butyl-1-[2-(2-methylpropyl)quinolin-4-yl]-3-(1,3-thiazol-2-yl)guanidine

Systemtic Name: 2-tert-butyl-1-[2-(2-methylpropyl)quinolin-4-yl]-3-(1,3-thiazol-2-yl)guanidine Openeye Name: 2-tert-butyl-1-(2-isobutyl-4-quinolyl)-3-thiazol-2-yl-guanidine CAS Name: 2-tert-butyl-1-[2-(2-methylpropyl)-4-quinolinyl]-3-(2-thiazolyl)guanidine IUPAC Name: 2-tert-butyl-1-[2-(2-methylpropyl)quinolin-4-yl]-3-(1,3-thiazol-2-yl)guanidine Traditional Name: 2-tert-butyl-1-(2-isobutyl-4-quinolyl)-3-thiazol-2-yl-guanidine Formula: C21H27N5S MolecularWeight: 381.53758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=CC=CC=C2C(=C1)NC(=NC(C)(C)C)NC3=NC=CS3

Isomeric SMILES

CC(C)CC1=NC2=CC=CC=C2C(=C1)NC(=NC(C)(C)C)NC3=NC=CS3

InChI

InChI=1S/C21H27N5S/c1-14(2)12-15-13-18(16-8-6-7-9-17(16)23-15)24-19(26-21(3,4)5)25-20-22-10-11-27-20/h6-11,13-14H,12H2,1-5H3,(H2,22,23,24,25,26)