ethyl 4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylthiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylthiomorpholine-3-carboxylate Openeye Name: ethyl 4-(3-methyl-4-oxo-phthalazine-1-carbonyl)thiomorpholine-3-carboxylate CAS Name: 4-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-methyl-4-oxophthalazine-1-carbonyl)thiomorpholine-3-carboxylate Traditional Name: 4-(4-keto-3-methyl-phthalazine-1-carbonyl)thiomorpholine-3-carboxylic acid ethyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C17H19N3O4S/c1-3-24-17(23)13-10-25-9-8-20(13)16(22)14-11-6-4-5-7-12(11)15(21)19(2)18-14/h4-7,13H,3,8-10H2,1-2H3