7-methoxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one CAS Name: 7-methoxy-4-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one Traditional Name: 7-methoxy-4-[[methyl-[4-(methylthio)benzyl]amino]methyl]coumarin Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C20H21NO3S/c1-21(12-14-4-7-17(25-3)8-5-14)13-15-10-20(22)24-19-11-16(23-2)6-9-18(15)19/h4-11H,12-13H2,1-3H3