tert-butyl N-[3-azanyl-4-[[(2-pyridin-4-yl-1,3-thiazol-4-yl)amino]methyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-azanyl-4-[[(2-pyridin-4-yl-1,3-thiazol-4-yl)amino]methyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-amino-4-[[[2-(4-pyridyl)thiazol-4-yl]amino]methyl]phenyl]carbamate CAS Name: N-[3-amino-4-[[(2-pyridin-4-yl-4-thiazolyl)amino]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-amino-4-[[(2-pyridin-4-yl-1,3-thiazol-4-yl)amino]methyl]phenyl]carbamate Traditional Name: N-[3-amino-4-[[[2-(4-pyridyl)thiazol-4-yl]amino]methyl]phenyl]carbamic acid tert-butyl ester Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=C(C=C1)CNC2=CSC(=N2)C3=CC=NC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=C(C=C1)CNC2=CSC(=N2)C3=CC=NC=C3)N

InChI

InChI=1S/C20H23N5O2S/c1-20(2,3)27-19(26)24-15-5-4-14(16(21)10-15)11-23-17-12-28-18(25-17)13-6-8-22-9-7-13/h4-10,12,23H,11,21H2,1-3H3,(H,24,26)