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

Systemtic Name: (phenylmethyl) 2-[2-(3-aminophenyl)-3-chloranyl-6-oxidanylidene-5-(propan-2-ylamino)pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[2-(3-aminophenyl)-3-chloro-5-(isopropylamino)-6-oxo-pyrazin-1-yl]acetate CAS Name: 2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-(propan-2-ylamino)-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(3-aminophenyl)-3-chloro-6-oxo-5-(propan-2-ylamino)pyrazin-1-yl]acetate Traditional Name: 2-[2-(3-aminophenyl)-3-chloro-5-(isopropylamino)-6-keto-pyrazin-1-yl]acetic acid benzyl ester Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN4O3/c1-14(2)25-21-22(29)27(12-18(28)30-13-15-7-4-3-5-8-15)19(20(23)26-21)16-9-6-10-17(24)11-16/h3-11,14H,12-13,24H2,1-2H3,(H,25,26)