(2S)-2-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-(3-methyl-4-oxo-phthalazin-1-yl)acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-(3-methyl-4-oxo-1-phthalazinyl)-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-(4-keto-3-methyl-phthalazin-1-yl)acetyl]amino]-N-propyl-propionamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C17H22N4O3/c1-4-9-18-16(23)11(2)19-15(22)10-14-12-7-5-6-8-13(12)17(24)21(3)20-14/h5-8,11H,4,9-10H2,1-3H3,(H,18,23)(H,19,22)/t11-/m0/s1