2-[(6-aminopurin-9-yl)methyl]-3-cyclopropyl-5-methyl-quinazolin-4-one

Systemtic Name: 2-[(6-aminopurin-9-yl)methyl]-3-cyclopropyl-5-methyl-quinazolin-4-one Openeye Name: 2-[(6-aminopurin-9-yl)methyl]-3-cyclopropyl-5-methyl-quinazolin-4-one CAS Name: 2-[(6-aminopurin-9-yl)methyl]-3-cyclopropyl-5-methyl-4-quinazolinone IUPAC Name: 2-[(6-aminopurin-9-yl)methyl]-3-cyclopropyl-5-methylquinazolin-4-one Traditional Name: 2-(adenin-9-ylmethyl)-3-cyclopropyl-5-methyl-quinazolin-4-one Formula: C18H17N7O MolecularWeight: 347.37388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3CC3)CN4C=NC5=C4N=CN=C5N

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3CC3)CN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C18H17N7O/c1-10-3-2-4-12-14(10)18(26)25(11-5-6-11)13(23-12)7-24-9-22-15-16(19)20-8-21-17(15)24/h2-4,8-9,11H,5-7H2,1H3,(H2,19,20,21)