7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-6-propan-2-yl-chromen-2-one

Systemtic Name: 7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]coumarin Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC=NC4=C3C=NN4C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC=NC4=C3C=NN4C)C(C)C

InChI

InChI=1S/C20H20N4O2S/c1-11(2)14-7-15-13(6-18(25)26-17(15)5-12(14)3)9-27-20-16-8-23-24(4)19(16)21-10-22-20/h5-8,10-11H,9H2,1-4H3