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

Systemtic Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-butanamide Openeye Name: N-cyclohexyl-2-[4-oxo-3-(p-tolylmethyl)pteridin-2-yl]sulfanyl-butanamide CAS Name: N-cyclohexyl-2-[[3-[(4-methylphenyl)methyl]-4-oxo-2-pteridinyl]thio]butanamide IUPAC Name: N-cyclohexyl-2-[3-[(4-methylphenyl)methyl]-4-oxopteridin-2-yl]sulfanylbutanamide Traditional Name: N-cyclohexyl-2-[[4-keto-3-(4-methylbenzyl)pteridin-2-yl]thio]butyramide Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)C

InChI

InChI=1S/C24H29N5O2S/c1-3-19(22(30)27-18-7-5-4-6-8-18)32-24-28-21-20(25-13-14-26-21)23(31)29(24)15-17-11-9-16(2)10-12-17/h9-14,18-19H,3-8,15H2,1-2H3,(H,27,30)