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

Systemtic Name: N-(4-methoxyphenyl)-2-[4-oxidanylidene-3-(phenylmethyl)pteridin-2-yl]sulfanyl-butanamide Openeye Name: 2-(3-benzyl-4-oxo-pteridin-2-yl)sulfanyl-N-(4-methoxyphenyl)butanamide CAS Name: N-(4-methoxyphenyl)-2-[[4-oxo-3-(phenylmethyl)-2-pteridinyl]thio]butanamide IUPAC Name: 2-(3-benzyl-4-oxopteridin-2-yl)sulfanyl-N-(4-methoxyphenyl)butanamide Traditional Name: 2-[(3-benzyl-4-keto-pteridin-2-yl)thio]-N-(4-methoxyphenyl)butyramide Formula: C24H23N5O3S MolecularWeight: 461.53612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23N5O3S/c1-3-19(22(30)27-17-9-11-18(32-2)12-10-17)33-24-28-21-20(25-13-14-26-21)23(31)29(24)15-16-7-5-4-6-8-16/h4-14,19H,3,15H2,1-2H3,(H,27,30)