(Z)-2-[9-(methoxymethyl)purin-6-yl]-3-[(phenylmethyl)amino]prop-2-enamide

Systemtic Name: (Z)-2-[9-(methoxymethyl)purin-6-yl]-3-[(phenylmethyl)amino]prop-2-enamide Openeye Name: (Z)-3-(benzylamino)-2-[9-(methoxymethyl)purin-6-yl]prop-2-enamide CAS Name: (Z)-2-[9-(methoxymethyl)-6-purinyl]-3-[(phenylmethyl)amino]-2-propenamide IUPAC Name: (Z)-3-(benzylamino)-2-[9-(methoxymethyl)purin-6-yl]prop-2-enamide Traditional Name: (Z)-3-(benzylamino)-2-[9-(methoxymethyl)purin-6-yl]acrylamide Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

COCN1C=NC2=C(N=CN=C21)C(=CNCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

COCN1C=NC2=C(N=CN=C21)/C(=C/NCC3=CC=CC=C3)/C(=O)N

InChI

InChI=1S/C17H18N6O2/c1-25-11-23-10-22-15-14(20-9-21-17(15)23)13(16(18)24)8-19-7-12-5-3-2-4-6-12/h2-6,8-10,19H,7,11H2,1H3,(H2,18,24)/b13-8-