2-(2-phenoxyethyl)-6-(2-thiophen-3-ylpyrrolidin-1-yl)carbonyl-pyridazin-3-one

Systemtic Name: 2-(2-phenoxyethyl)-6-(2-thiophen-3-ylpyrrolidin-1-yl)carbonyl-pyridazin-3-one Openeye Name: 2-(2-phenoxyethyl)-6-[2-(3-thienyl)pyrrolidine-1-carbonyl]pyridazin-3-one CAS Name: 6-[oxo-[2-(3-thiophenyl)-1-pyrrolidinyl]methyl]-2-(2-phenoxyethyl)-3-pyridazinone IUPAC Name: 2-(2-phenoxyethyl)-6-(2-thiophen-3-ylpyrrolidine-1-carbonyl)pyridazin-3-one Traditional Name: 2-(2-phenoxyethyl)-6-[2-(3-thienyl)pyrrolidine-1-carbonyl]pyridazin-3-one Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C21H21N3O3S/c25-20-9-8-18(22-24(20)12-13-27-17-5-2-1-3-6-17)21(26)23-11-4-7-19(23)16-10-14-28-15-16/h1-3,5-6,8-10,14-15,19H,4,7,11-13H2