N-[4-chloranyl-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide

Systemtic Name: N-[4-chloranyl-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide Openeye Name: N-[4-chloro-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide CAS Name: N-[4-chloro-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide IUPAC Name: N-[4-chloro-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide Traditional Name: N-[4-chloro-3-(1,3-dioxolan-2-yl)phenyl]-4,5-dihydro-3H-pyridazine-2-carbothioamide Formula: C14H16ClN3O2S MolecularWeight: 325.81374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=NN(C1)C(=S)NC2=CC(=C(C=C2)Cl)C3OCCO3

Isomeric SMILES

C1CC=NN(C1)C(=S)NC2=CC(=C(C=C2)Cl)C3OCCO3

InChI

InChI=1S/C14H16ClN3O2S/c15-12-4-3-10(9-11(12)13-19-7-8-20-13)17-14(21)18-6-2-1-5-16-18/h3-5,9,13H,1-2,6-8H2,(H,17,21)