tert-butyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]amino]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]amino]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]amino]-3-oxo-propyl]carbamate CAS Name: N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]amino]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]amino]-3-oxopropyl]carbamate Traditional Name: N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]amino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NC(CCSC)C1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1

InChI

InChI=1S/C19H28N4O3S/c1-19(2,3)26-18(25)20-11-9-16(24)21-15(10-12-27-4)17-22-13-7-5-6-8-14(13)23-17/h5-8,15H,9-12H2,1-4H3,(H,20,25)(H,21,24)(H,22,23)/t15-/m0/s1