2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)pteridin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)pteridin-4-one Openeye Name: 3-isopentyl-2-[(3-methoxyphenyl)methylsulfanyl]pteridin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-3-(3-methylbutyl)-4-pteridinone IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(3-methylbutyl)pteridin-4-one Traditional Name: 3-isoamyl-2-(m-anisylthio)pteridin-4-one Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=NC=CN=C2N=C1SCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CCN1C(=O)C2=NC=CN=C2N=C1SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H22N4O2S/c1-13(2)7-10-23-18(24)16-17(21-9-8-20-16)22-19(23)26-12-14-5-4-6-15(11-14)25-3/h4-6,8-9,11,13H,7,10,12H2,1-3H3