methyl 4-[3-chloranyl-5-[2-(1H-indol-3-yl)ethylamino]-6-oxidanylidene-1-phenyl-pyrazin-2-yl]benzoate

Systemtic Name: methyl 4-[3-chloranyl-5-[2-(1H-indol-3-yl)ethylamino]-6-oxidanylidene-1-phenyl-pyrazin-2-yl]benzoate Openeye Name: methyl 4-[3-chloro-5-[2-(1H-indol-3-yl)ethylamino]-6-oxo-1-phenyl-pyrazin-2-yl]benzoate CAS Name: 4-[3-chloro-5-[2-(1H-indol-3-yl)ethylamino]-6-oxo-1-phenyl-2-pyrazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-chloro-5-[2-(1H-indol-3-yl)ethylamino]-6-oxo-1-phenylpyrazin-2-yl]benzoate Traditional Name: 4-[3-chloro-5-[2-(1H-indol-3-yl)ethylamino]-6-keto-1-phenyl-pyrazin-2-yl]benzoic acid methyl ester Formula: C28H23ClN4O3 MolecularWeight: 498.96022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C(N=C(C(=O)N2C3=CC=CC=C3)NCCC4=CNC5=CC=CC=C54)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C(N=C(C(=O)N2C3=CC=CC=C3)NCCC4=CNC5=CC=CC=C54)Cl

InChI

InChI=1S/C28H23ClN4O3/c1-36-28(35)19-13-11-18(12-14-19)24-25(29)32-26(27(34)33(24)21-7-3-2-4-8-21)30-16-15-20-17-31-23-10-6-5-9-22(20)23/h2-14,17,31H,15-16H2,1H3,(H,30,32)