4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methyl-benzenecarbonitrile

Systemtic Name: 4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methyl-benzenecarbonitrile Openeye Name: 4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methyl-benzonitrile CAS Name: 4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methylbenzonitrile IUPAC Name: 4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methylbenzonitrile Traditional Name: 4-[4-[butyl(ethyl)amino]-2-methyl-6,7-dihydro-5H-pteridin-8-yl]-3-methyl-benzonitrile Formula: C21H28N6 MolecularWeight: 364.48722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=NC(=NC2=C1NCCN2C3=C(C=C(C=C3)C#N)C)C

Isomeric SMILES

CCCCN(CC)C1=NC(=NC2=C1NCCN2C3=C(C=C(C=C3)C#N)C)C

InChI

InChI=1S/C21H28N6/c1-5-7-11-26(6-2)20-19-21(25-16(4)24-20)27(12-10-23-19)18-9-8-17(14-22)13-15(18)3/h8-9,13,23H,5-7,10-12H2,1-4H3