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

Systemtic Name: 6-ethyl-7-oxidanyl-4-[[[(R)-phenyl(thiophen-2-yl)methyl]amino]methyl]chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[[(R)-phenyl(2-thienyl)methyl]amino]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[[(R)-phenyl(thiophen-2-yl)methyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[[(R)-phenyl(thiophen-2-yl)methyl]amino]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[[(R)-phenyl(2-thienyl)methyl]amino]methyl]coumarin Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC(C3=CC=CC=C3)C4=CC=CS4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN[C@H](C3=CC=CC=C3)C4=CC=CS4)O

InChI

InChI=1S/C23H21NO3S/c1-2-15-11-18-17(12-22(26)27-20(18)13-19(15)25)14-24-23(21-9-6-10-28-21)16-7-4-3-5-8-16/h3-13,23-25H,2,14H2,1H3/t23-/m1/s1