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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26ClN3O3/c1-3-10-17(2)26-23-24(30)28(15-20(29)31-16-18-11-6-4-7-12-18)21(22(25)27-23)19-13-8-5-9-14-19/h4-9,11-14,17H,3,10,15-16H2,1-2H3,(H,26,27)