propan-2-yl 2-[4-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-oxidanylidene-5,6,7,8-tetrahydrophthalazin-2-yl]ethanoate

Systemtic Name: propan-2-yl 2-[4-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-oxidanylidene-5,6,7,8-tetrahydrophthalazin-2-yl]ethanoate Openeye Name: isopropyl 2-[4-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2-yl]acetate CAS Name: 2-[4-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-1-oxo-5,6,7,8-tetrahydrophthalazin-2-yl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2-yl]acetate Traditional Name: 2-[1-keto-4-(4-methyl-3-pyrrolidinosulfonyl-phenyl)-5,6,7,8-tetrahydrophthalazin-2-yl]acetic acid isopropyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=C2CCCC3)CC(=O)OC(C)C)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=C2CCCC3)CC(=O)OC(C)C)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H31N3O5S/c1-16(2)32-22(28)15-27-24(29)20-9-5-4-8-19(20)23(25-27)18-11-10-17(3)21(14-18)33(30,31)26-12-6-7-13-26/h10-11,14,16H,4-9,12-13,15H2,1-3H3