methyl 3-[(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[(5-morpholino-4-phenyl-thiophene-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: 3-[[[5-(4-morpholinyl)-4-phenyl-2-thiophenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[(5-morpholin-4-yl-4-phenylthiophene-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[(5-morpholino-4-phenyl-thiophene-2-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O4S/c1-30-23(28)17-21(19-10-6-3-7-11-19)26-24(29)22-16-20(18-8-4-2-5-9-18)25(32-22)27-12-14-31-15-13-27/h2-11,16,21H,12-15,17H2,1H3,(H,26,29)