(Z)-3-[(phenylmethyl)amino]-2-(7H-purin-6-yl)prop-2-enamide

Systemtic Name: (Z)-3-[(phenylmethyl)amino]-2-(7H-purin-6-yl)prop-2-enamide Openeye Name: (Z)-3-(benzylamino)-2-(7H-purin-6-yl)prop-2-enamide CAS Name: (Z)-3-[(phenylmethyl)amino]-2-(7H-purin-6-yl)-2-propenamide IUPAC Name: (Z)-3-(benzylamino)-2-(7H-purin-6-yl)prop-2-enamide Traditional Name: (Z)-3-(benzylamino)-2-(7H-purin-6-yl)acrylamide Formula: C15H14N6O MolecularWeight: 294.31126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC=C(C2=C3C(=NC=N2)N=CN3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN/C=C(/C2=C3C(=NC=N2)N=CN3)\C(=O)N

InChI

InChI=1S/C15H14N6O/c16-14(22)11(7-17-6-10-4-2-1-3-5-10)12-13-15(20-8-18-12)21-9-19-13/h1-5,7-9,17H,6H2,(H2,16,22)(H,18,19,20,21)/b11-7-