2-[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]-N-methylsulfonyl-ethanamide

Systemtic Name: 2-[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]-N-methylsulfonyl-ethanamide Openeye Name: 2-[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxo-phthalazin-2-yl]-N-methylsulfonyl-acetamide CAS Name: 2-[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxo-2-phthalazinyl]-N-methylsulfonylacetamide IUPAC Name: 2-[4-[(4-methyl-1H-indol-3-yl)methyl]-1-oxophthalazin-2-yl]-N-methylsulfonylacetamide Traditional Name: 2-[1-keto-4-[(4-methyl-1H-indol-3-yl)methyl]phthalazin-2-yl]-N-mesyl-acetamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC(=O)NS(=O)(=O)C

InChI

InChI=1S/C21H20N4O4S/c1-13-6-5-9-17-20(13)14(11-22-17)10-18-15-7-3-4-8-16(15)21(27)25(23-18)12-19(26)24-30(2,28)29/h3-9,11,22H,10,12H2,1-2H3,(H,24,26)