N-[(E)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(E)-(5-morpholino-2-thienyl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(E)-[5-(4-morpholinyl)-2-thiophenyl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(E)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(E)-(5-morpholino-2-thienyl)methyleneamino]-3H-phthalazine-1-carboxamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(S2)C=NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1COCCN1C2=CC=C(S2)/C=N/NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H17N5O3S/c24-17-14-4-2-1-3-13(14)16(20-22-17)18(25)21-19-11-12-5-6-15(27-12)23-7-9-26-10-8-23/h1-6,11H,7-10H2,(H,21,25)(H,22,24)/b19-11+