N-cyclohexyl-2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-butanamide

Systemtic Name: N-cyclohexyl-2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-butanamide Openeye Name: N-cyclohexyl-2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-pteridin-2-yl]sulfanyl-butanamide CAS Name: N-cyclohexyl-2-[[3-[2-(1H-indol-3-yl)ethyl]-4-oxo-2-pteridinyl]thio]butanamide IUPAC Name: N-cyclohexyl-2-[3-[2-(1H-indol-3-yl)ethyl]-4-oxopteridin-2-yl]sulfanylbutanamide Traditional Name: N-cyclohexyl-2-[[3-[2-(1H-indol-3-yl)ethyl]-4-keto-pteridin-2-yl]thio]butyramide Formula: C26H30N6O2S MolecularWeight: 490.6204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)SC2=NC3=NC=CN=C3C(=O)N2CCC4=CNC5=CC=CC=C54

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)SC2=NC3=NC=CN=C3C(=O)N2CCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H30N6O2S/c1-2-21(24(33)30-18-8-4-3-5-9-18)35-26-31-23-22(27-13-14-28-23)25(34)32(26)15-12-17-16-29-20-11-7-6-10-19(17)20/h6-7,10-11,13-14,16,18,21,29H,2-5,8-9,12,15H2,1H3,(H,30,33)