tert-butyl N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-oxo-propyl]carbamate CAS Name: N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-oxopropyl]carbamate Traditional Name: N-[3-(1,3-benzothiazol-2-ylmethylamino)-3-keto-propyl]carbamic acid tert-butyl ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H21N3O3S/c1-16(2,3)22-15(21)17-9-8-13(20)18-10-14-19-11-6-4-5-7-12(11)23-14/h4-7H,8-10H2,1-3H3,(H,17,21)(H,18,20)