4-(5-ethylthiophen-2-yl)-2-(2-imidazol-1-ylethyl)-5,6,7,8-tetrahydrophthalazin-1-one

Systemtic Name: 4-(5-ethylthiophen-2-yl)-2-(2-imidazol-1-ylethyl)-5,6,7,8-tetrahydrophthalazin-1-one Openeye Name: 4-(5-ethyl-2-thienyl)-2-(2-imidazol-1-ylethyl)-5,6,7,8-tetrahydrophthalazin-1-one CAS Name: 4-(5-ethyl-2-thiophenyl)-2-[2-(1-imidazolyl)ethyl]-5,6,7,8-tetrahydrophthalazin-1-one IUPAC Name: 4-(5-ethylthiophen-2-yl)-2-(2-imidazol-1-ylethyl)-5,6,7,8-tetrahydrophthalazin-1-one Traditional Name: 4-(5-ethyl-2-thienyl)-2-(2-imidazol-1-ylethyl)-5,6,7,8-tetrahydrophthalazin-1-one Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NN(C(=O)C3=C2CCCC3)CCN4C=CN=C4

Isomeric SMILES

CCC1=CC=C(S1)C2=NN(C(=O)C3=C2CCCC3)CCN4C=CN=C4

InChI

InChI=1S/C19H22N4OS/c1-2-14-7-8-17(25-14)18-15-5-3-4-6-16(15)19(24)23(21-18)12-11-22-10-9-20-13-22/h7-10,13H,2-6,11-12H2,1H3