3-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 3-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide Openeye Name: 3-(3,6-dioxo-1H-pyridazin-2-yl)-N-[2-(2-thienylmethylsulfanyl)ethyl]propanamide CAS Name: 3-(3,6-dioxo-1H-pyridazin-2-yl)-N-[2-(thiophen-2-ylmethylthio)ethyl]propanamide IUPAC Name: 3-(3,6-dioxo-1H-pyridazin-2-yl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]propanamide Traditional Name: 3-(3,6-diketo-1H-pyridazin-2-yl)-N-[2-(2-thenylthio)ethyl]propionamide Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCCNC(=O)CCN2C(=O)C=CC(=O)N2

Isomeric SMILES

C1=CSC(=C1)CSCCNC(=O)CCN2C(=O)C=CC(=O)N2

InChI

InChI=1S/C14H17N3O3S2/c18-12(5-7-17-14(20)4-3-13(19)16-17)15-6-9-21-10-11-2-1-8-22-11/h1-4,8H,5-7,9-10H2,(H,15,18)(H,16,19)