ethyl 3-[[2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]phenyl]sulfanylcarbonylamino]propanoate

Systemtic Name: ethyl 3-[[2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]phenyl]sulfanylcarbonylamino]propanoate Openeye Name: ethyl 3-[[2-[(3-amino-3-oxo-propyl)carbamoyl]phenyl]sulfanylcarbonylamino]propanoate CAS Name: 3-[[[[2-[[(3-amino-3-oxopropyl)amino]-oxomethyl]phenyl]thio]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(3-amino-3-oxopropyl)carbamoyl]phenyl]sulfanylcarbonylamino]propanoate Traditional Name: 3-[[[2-[(3-amino-3-keto-propyl)carbamoyl]phenyl]thio]carbonylamino]propionic acid ethyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)SC1=CC=CC=C1C(=O)NCCC(=O)N

Isomeric SMILES

CCOC(=O)CCNC(=O)SC1=CC=CC=C1C(=O)NCCC(=O)N

InChI

InChI=1S/C16H21N3O5S/c1-2-24-14(21)8-10-19-16(23)25-12-6-4-3-5-11(12)15(22)18-9-7-13(17)20/h3-6H,2,7-10H2,1H3,(H2,17,20)(H,18,22)(H,19,23)