5-[(3-methylthiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione

Systemtic Name: 5-[(3-methylthiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione Openeye Name: 5-[(3-methyl-2-thienyl)methylamino]-2,3-dihydrophthalazine-1,4-dione CAS Name: 5-[(3-methyl-2-thiophenyl)methylamino]-2,3-dihydrophthalazine-1,4-dione IUPAC Name: 5-[(3-methylthiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione Traditional Name: 5-[(3-methyl-2-thienyl)methylamino]-2,3-dihydrophthalazine-1,4-quinone Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC2=CC=CC3=C2C(=O)NNC3=O

Isomeric SMILES

CC1=C(SC=C1)CNC2=CC=CC3=C2C(=O)NNC3=O

InChI

InChI=1S/C14H13N3O2S/c1-8-5-6-20-11(8)7-15-10-4-2-3-9-12(10)14(19)17-16-13(9)18/h2-6,15H,7H2,1H3,(H,16,18)(H,17,19)