N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3H-phthalazine-1-carboxamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=N2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C17H16N4O2S/c1-9-6-7-12-13(8-9)24-17(18-12)19-16(23)14-10-4-2-3-5-11(10)15(22)21-20-14/h2-5,9H,6-8H2,1H3,(H,21,22)(H,18,19,23)/t9-/m0/s1