N-(3-methoxyphenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(3-methoxyphenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-butanamide Openeye Name: N-(3-methoxyphenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-butanamide CAS Name: N-(3-methoxyphenyl)-2-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-pteridinyl]thio]butanamide IUPAC Name: N-(3-methoxyphenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxopteridin-2-yl]sulfanylbutanamide Traditional Name: 2-[(4-keto-3-p-anisyl-pteridin-2-yl)thio]-N-(3-methoxyphenyl)butyramide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H25N5O4S/c1-4-20(23(31)28-17-6-5-7-19(14-17)34-3)35-25-29-22-21(26-12-13-27-22)24(32)30(25)15-16-8-10-18(33-2)11-9-16/h5-14,20H,4,15H2,1-3H3,(H,28,31)