(2S)-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-(1,3-thiazol-2-yl)propanamide

Systemtic Name: (2S)-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-(1,3-thiazol-2-yl)propanamide Openeye Name: (2S)-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]-N-thiazol-2-yl-propanamide CAS Name: (2S)-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]-N-(2-thiazolyl)propanamide IUPAC Name: (2S)-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]-N-(1,3-thiazol-2-yl)propanamide Traditional Name: (2S)-2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]-N-thiazol-2-yl-propionamide Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CS1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=CS1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H15N5O3S/c1-9(14(23)19-16-17-6-7-25-16)18-13(22)8-12-10-4-2-3-5-11(10)15(24)21-20-12/h2-7,9H,8H2,1H3,(H,18,22)(H,21,24)(H,17,19,23)/t9-/m0/s1