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

Systemtic Name: 2-[(6-aminopurin-9-yl)methyl]-3-(cyclopropylmethyl)-5-methyl-quinazolin-4-one Openeye Name: 2-[(6-aminopurin-9-yl)methyl]-3-(cyclopropylmethyl)-5-methyl-quinazolin-4-one CAS Name: 2-[(6-aminopurin-9-yl)methyl]-3-(cyclopropylmethyl)-5-methyl-4-quinazolinone IUPAC Name: 2-[(6-aminopurin-9-yl)methyl]-3-(cyclopropylmethyl)-5-methylquinazolin-4-one Traditional Name: 2-(adenin-9-ylmethyl)-3-(cyclopropylmethyl)-5-methyl-quinazolin-4-one Formula: C19H19N7O MolecularWeight: 361.40046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)CC3CC3)CN4C=NC5=C4N=CN=C5N

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)CC3CC3)CN4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C19H19N7O/c1-11-3-2-4-13-15(11)19(27)26(7-12-5-6-12)14(24-13)8-25-10-23-16-17(20)21-9-22-18(16)25/h2-4,9-10,12H,5-8H2,1H3,(H2,20,21,22)