tert-butyl N-[3-ethylsulfanyl-1-oxidanylidene-1-(1H-pyrrol-2-ylamino)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-ethylsulfanyl-1-oxidanylidene-1-(1H-pyrrol-2-ylamino)propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(ethylsulfanylmethyl)-2-oxo-2-(1H-pyrrol-2-ylamino)ethyl]carbamate CAS Name: N-[3-(ethylthio)-1-oxo-1-(1H-pyrrol-2-ylamino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-ethylsulfanyl-1-oxo-1-(1H-pyrrol-2-ylamino)propan-2-yl]carbamate Traditional Name: N-[1-[(ethylthio)methyl]-2-keto-2-(1H-pyrrol-2-ylamino)ethyl]carbamic acid tert-butyl ester Formula: C14H23N3O3S MolecularWeight: 313.41572

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(C(=O)NC1=CC=CN1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCSCC(C(=O)NC1=CC=CN1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H23N3O3S/c1-5-21-9-10(16-13(19)20-14(2,3)4)12(18)17-11-7-6-8-15-11/h6-8,10,15H,5,9H2,1-4H3,(H,16,19)(H,17,18)