N-(4-methoxyphenyl)-3-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-butanamide

Systemtic Name: N-(4-methoxyphenyl)-3-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-(4-methoxyphenyl)-3-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-(4-methoxyphenyl)-3-methyl-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]butanamide IUPAC Name: N-(4-methoxyphenyl)-3-methyl-2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-(4-methoxyphenyl)-3-methyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]butyramide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)SC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2S/c1-15(2)20(22(29)27-16-9-11-18(30-3)12-10-16)31-23-19-13-26-28(21(19)24-14-25-23)17-7-5-4-6-8-17/h4-15,20H,1-3H3,(H,27,29)