tert-butyl N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-oxo-butyl]carbamate CAS Name: N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-oxobutyl]carbamate Traditional Name: N-[4-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-4-keto-butyl]carbamic acid tert-butyl ester Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)N(C)CC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)N(C)CC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C18H25N3O3S/c1-18(2,3)24-17(23)19-11-7-10-16(22)21(4)12-15-20-13-8-5-6-9-14(13)25-15/h5-6,8-9H,7,10-12H2,1-4H3,(H,19,23)