tert-butyl 3-(2-azanyloxyethyl)-2-methyl-5-(1,3-thiazol-2-ylmethoxy)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-azanyloxyethyl)-2-methyl-5-(1,3-thiazol-2-ylmethoxy)indole-1-carboxylate Openeye Name: tert-butyl 3-(2-aminooxyethyl)-2-methyl-5-(thiazol-2-ylmethoxy)indole-1-carboxylate CAS Name: 3-(2-aminooxyethyl)-2-methyl-5-(2-thiazolylmethoxy)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-aminooxyethyl)-2-methyl-5-(1,3-thiazol-2-ylmethoxy)indole-1-carboxylate Traditional Name: 3-(2-aminooxyethyl)-2-methyl-5-(thiazol-2-ylmethoxy)indole-1-carboxylic acid tert-butyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=CC(=C2)OCC3=NC=CS3)CCON

Isomeric SMILES

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=CC(=C2)OCC3=NC=CS3)CCON

InChI

InChI=1S/C20H25N3O4S/c1-13-15(7-9-26-21)16-11-14(25-12-18-22-8-10-28-18)5-6-17(16)23(13)19(24)27-20(2,3)4/h5-6,8,10-11H,7,9,12,21H2,1-4H3