7-methyl-6-propan-2-yl-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 7-methyl-6-propan-2-yl-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-(2-pyridylsulfanylmethyl)chromen-2-one CAS Name: 7-methyl-6-propan-2-yl-4-[(2-pyridinylthio)methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-6-propan-2-yl-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[(2-pyridylthio)methyl]coumarin Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC=CC=N3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC=CC=N3)C(C)C

InChI

InChI=1S/C19H19NO2S/c1-12(2)15-10-16-14(11-23-18-6-4-5-7-20-18)9-19(21)22-17(16)8-13(15)3/h4-10,12H,11H2,1-3H3