methyl 3-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-(2-thienyl)-3-[[4-(ureidomethyl)benzoyl]amino]propanoate CAS Name: 3-[[[4-[(carbamoylamino)methyl]phenyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[4-[(carbamoylamino)methyl]benzoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)-3-[[4-(ureidomethyl)benzoyl]amino]propionic acid methyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CNC(=O)N

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CNC(=O)N

InChI

InChI=1S/C17H19N3O4S/c1-24-15(21)9-13(14-3-2-8-25-14)20-16(22)12-6-4-11(5-7-12)10-19-17(18)23/h2-8,13H,9-10H2,1H3,(H,20,22)(H3,18,19,23)