8-(2-azanyl-4-chloranyl-phenyl)-3-methyl-1-prop-2-enyl-7H-purine-2,6-dione

Systemtic Name: 8-(2-azanyl-4-chloranyl-phenyl)-3-methyl-1-prop-2-enyl-7H-purine-2,6-dione Openeye Name: 1-allyl-8-(2-amino-4-chloro-phenyl)-3-methyl-7H-purine-2,6-dione CAS Name: 8-(2-amino-4-chlorophenyl)-3-methyl-1-prop-2-enyl-7H-purine-2,6-dione IUPAC Name: 8-(2-amino-4-chlorophenyl)-3-methyl-1-prop-2-enyl-7H-purine-2,6-dione Traditional Name: 1-allyl-8-(2-amino-4-chloro-phenyl)-3-methyl-7H-purine-2,6-quinone Formula: C15H14ClN5O2 MolecularWeight: 331.75696

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC=C)NC(=N2)C3=C(C=C(C=C3)Cl)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC=C)NC(=N2)C3=C(C=C(C=C3)Cl)N

InChI

InChI=1S/C15H14ClN5O2/c1-3-6-21-14(22)11-13(20(2)15(21)23)19-12(18-11)9-5-4-8(16)7-10(9)17/h3-5,7H,1,6,17H2,2H3,(H,18,19)