tert-butyl N-[(2S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[2-(1,2-benzothiazol-3-ylamino)ethylcarbamoyl]-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCNC1=NSC2=CC=CC=C21)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCNC1=NSC2=CC=CC=C21)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N4O3S/c1-12(2)15(22-18(25)26-19(3,4)5)17(24)21-11-10-20-16-13-8-6-7-9-14(13)27-23-16/h6-9,12,15H,10-11H2,1-5H3,(H,20,23)(H,21,24)(H,22,25)/t15-/m0/s1