4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-(2-methylpropyl)phthalazin-1-one

Systemtic Name: 4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-(2-methylpropyl)phthalazin-1-one Openeye Name: 4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-isobutyl-phthalazin-1-one CAS Name: 4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-(2-methylpropyl)-1-phthalazinone IUPAC Name: 4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 4-[5-(ethylamino)-1,3,4-thiadiazol-2-yl]-2-isobutyl-phthalazin-1-one Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCNC1=NN=C(S1)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C16H19N5OS/c1-4-17-16-19-18-14(23-16)13-11-7-5-6-8-12(11)15(22)21(20-13)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,17,19)