8-(2-bromanyl-4-propan-2-yl-phenyl)-N4-hexan-3-yl-2-methyl-7H-pteridine-4,6-diamine

Systemtic Name: 8-(2-bromanyl-4-propan-2-yl-phenyl)-N4-hexan-3-yl-2-methyl-7H-pteridine-4,6-diamine Openeye Name: 8-(2-bromo-4-isopropyl-phenyl)-N4-(1-ethylbutyl)-2-methyl-7H-pteridine-4,6-diamine CAS Name: 8-(2-bromo-4-propan-2-ylphenyl)-N4-hexan-3-yl-2-methyl-7H-pteridine-4,6-diamine IUPAC Name: 8-(2-bromo-4-propan-2-ylphenyl)-4-N-hexan-3-yl-2-methyl-7H-pteridine-4,6-diamine Traditional Name: [6-amino-8-(2-bromo-4-isopropyl-phenyl)-2-methyl-7H-pteridin-4-yl]-(1-ethylbutyl)amine Formula: C22H31BrN6 MolecularWeight: 459.42574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)NC1=NC(=NC2=C1N=C(CN2C3=C(C=C(C=C3)C(C)C)Br)N)C

Isomeric SMILES

CCCC(CC)NC1=NC(=NC2=C1N=C(CN2C3=C(C=C(C=C3)C(C)C)Br)N)C

InChI

InChI=1S/C22H31BrN6/c1-6-8-16(7-2)27-21-20-22(26-14(5)25-21)29(12-19(24)28-20)18-10-9-15(13(3)4)11-17(18)23/h9-11,13,16H,6-8,12H2,1-5H3,(H2,24,28)(H,25,26,27)