4-[[2-(furan-2-ylmethylsulfanyl)ethylamino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[2-(furan-2-ylmethylsulfanyl)ethylamino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[2-(2-furylmethylsulfanyl)ethylamino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[2-(2-furanylmethylthio)ethylamino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(furan-2-ylmethylsulfanyl)ethylamino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[2-(2-furfurylthio)ethylamino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CNCCSCC3=CC=CO3)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CNCCSCC3=CC=CO3)O

InChI

InChI=1S/C18H19NO4S/c1-12-16(20)5-4-15-13(9-17(21)23-18(12)15)10-19-6-8-24-11-14-3-2-7-22-14/h2-5,7,9,19-20H,6,8,10-11H2,1H3