[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(aminocarbonylamino)-3-phenyl-propanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-phenyl-3-ureido-propanoate CAS Name: 3-(carbamoylamino)-3-phenylpropanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-(carbamoylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-3-ureido-propionic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)OCC(=O)NCC2=CC=CS2)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)OCC(=O)NCC2=CC=CS2)NC(=O)N

InChI

InChI=1S/C17H19N3O4S/c18-17(23)20-14(12-5-2-1-3-6-12)9-16(22)24-11-15(21)19-10-13-7-4-8-25-13/h1-8,14H,9-11H2,(H,19,21)(H3,18,20,23)