(phenylmethyl) 2-[5-chloranyl-2-oxidanylidene-3-(pentan-3-ylamino)-6-phenyl-pyrazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[5-chloranyl-2-oxidanylidene-3-(pentan-3-ylamino)-6-phenyl-pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[5-chloro-3-(1-ethylpropylamino)-2-oxo-6-phenyl-pyrazin-1-yl]acetate CAS Name: 2-[5-chloro-2-oxo-3-(pentan-3-ylamino)-6-phenyl-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[5-chloro-2-oxo-3-(pentan-3-ylamino)-6-phenylpyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-3-(1-ethylpropylamino)-2-keto-6-phenyl-pyrazin-1-yl]acetic acid benzyl ester Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=NC(=C(N(C1=O)CC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCC(CC)NC1=NC(=C(N(C1=O)CC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C24H26ClN3O3/c1-3-19(4-2)26-23-24(30)28(15-20(29)31-16-17-11-7-5-8-12-17)21(22(25)27-23)18-13-9-6-10-14-18/h5-14,19H,3-4,15-16H2,1-2H3,(H,26,27)