3-[2-(ethylamino)-6-(1-methylindol-3-yl)-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[2-(ethylamino)-6-(1-methylindol-3-yl)-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[2-(ethylamino)-6-(1-methylindol-3-yl)-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[2-(ethylamino)-6-(1-methyl-3-indolyl)-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[2-(ethylamino)-6-(1-methylindol-3-yl)-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[2-(ethylamino)-7-keto-6-(1-methylindol-3-yl)pteridin-8-yl]propionitrile Formula: C20H19N7O MolecularWeight: 373.41116

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CN(C4=CC=CC=C43)C)CCC#N

Isomeric SMILES

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CN(C4=CC=CC=C43)C)CCC#N

InChI

InChI=1S/C20H19N7O/c1-3-22-20-23-11-15-18(25-20)27(10-6-9-21)19(28)17(24-15)14-12-26(2)16-8-5-4-7-13(14)16/h4-5,7-8,11-12H,3,6,10H2,1-2H3,(H,22,23,25)