3-(prop-2-enoylamino)-N-(7H-purin-6-yl)benzamide

Systemtic Name: 3-(prop-2-enoylamino)-N-(7H-purin-6-yl)benzamide Openeye Name: 3-(prop-2-enoylamino)-N-(7H-purin-6-yl)benzamide CAS Name: 3-(1-oxoprop-2-enylamino)-N-(7H-purin-6-yl)benzamide IUPAC Name: 3-(prop-2-enoylamino)-N-(7H-purin-6-yl)benzamide Traditional Name: 3-acrylamido-N-(7H-purin-6-yl)benzamide Formula: C15H12N6O2 MolecularWeight: 308.29478

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC1=CC=CC(=C1)C(=O)NC2=NC=NC3=C2NC=N3

Isomeric SMILES

C=CC(=O)NC1=CC=CC(=C1)C(=O)NC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C15H12N6O2/c1-2-11(22)20-10-5-3-4-9(6-10)15(23)21-14-12-13(17-7-16-12)18-8-19-14/h2-8H,1H2,(H,20,22)(H2,16,17,18,19,21,23)