2-azanylethanoyl 2-(2-azanylethyl)-4-(3-ethoxybutanethioylamino)-3-oxidanylidene-butanoate

Systemtic Name: 2-azanylethanoyl 2-(2-azanylethyl)-4-(3-ethoxybutanethioylamino)-3-oxidanylidene-butanoate Openeye Name: (2-aminoacetyl) 2-(2-aminoethyl)-4-(3-ethoxybutanethioylamino)-3-oxo-butanoate CAS Name: 2-(2-aminoethyl)-4-[(3-ethoxy-1-sulfanylidenebutyl)amino]-3-oxobutanoic acid (2-amino-1-oxoethyl) ester IUPAC Name: (2-aminoacetyl) 2-(2-aminoethyl)-4-(3-ethoxybutanethioylamino)-3-oxobutanoate Traditional Name: 2-(2-aminoethyl)-4-(3-ethoxybutanethioylamino)-3-keto-butyric acid glycyl ester Formula: C14H25N3O5S MolecularWeight: 347.4304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)CC(=S)NCC(=O)C(CCN)C(=O)OC(=O)CN

Isomeric SMILES

CCOC(C)CC(=S)NCC(=O)C(CCN)C(=O)OC(=O)CN

InChI

InChI=1S/C14H25N3O5S/c1-3-21-9(2)6-12(23)17-8-11(18)10(4-5-15)14(20)22-13(19)7-16/h9-10H,3-8,15-16H2,1-2H3,(H,17,23)