N-(3-azanylpropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide

Systemtic Name: N-(3-azanylpropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide Openeye Name: N-(3-aminopropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide CAS Name: N-(3-aminopropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide IUPAC Name: N-(3-aminopropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide Traditional Name: N-(3-aminopropyl)-3-methoxy-4-(7H-purin-8-yl)benzamide Formula: C16H18N6O2 MolecularWeight: 326.35312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCCCN)C2=NC3=NC=NC=C3N2

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCCCN)C2=NC3=NC=NC=C3N2

InChI

InChI=1S/C16H18N6O2/c1-24-13-7-10(16(23)19-6-2-5-17)3-4-11(13)14-21-12-8-18-9-20-15(12)22-14/h3-4,7-9H,2,5-6,17H2,1H3,(H,19,23)(H,18,20,21,22)