7-ethyl-4-[[[(2R)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]methyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[[[(2R)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]amino]methyl]chromen-2-one Openeye Name: 7-ethyl-4-[[[(2R)-2-morpholino-2-(2-thienyl)ethyl]amino]methyl]chromen-2-one CAS Name: 7-ethyl-4-[[[(2R)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]methyl]chromen-2-one Traditional Name: 7-ethyl-4-[[[(2R)-2-morpholino-2-(2-thienyl)ethyl]amino]methyl]coumarin Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNCC(C3=CC=CS3)N4CCOCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=CS3)N4CCOCC4

InChI

InChI=1S/C22H26N2O3S/c1-2-16-5-6-18-17(13-22(25)27-20(18)12-16)14-23-15-19(21-4-3-11-28-21)24-7-9-26-10-8-24/h3-6,11-13,19,23H,2,7-10,14-15H2,1H3/t19-/m1/s1