N-[6-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[6-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]thiophene-2-carboxamide Openeye Name: N-[6-[4-(2-furylmethylamino)-4-oxo-butyl]sulfanylpyridazin-3-yl]thiophene-2-carboxamide CAS Name: N-[6-[[4-(2-furanylmethylamino)-4-oxobutyl]thio]-3-pyridazinyl]-2-thiophenecarboxamide IUPAC Name: N-[6-[4-(furan-2-ylmethylamino)-4-oxobutyl]sulfanylpyridazin-3-yl]thiophene-2-carboxamide Traditional Name: N-[6-[[4-(2-furfurylamino)-4-keto-butyl]thio]pyridazin-3-yl]thiophene-2-carboxamide Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=COC(=C1)CNC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C18H18N4O3S2/c23-16(19-12-13-4-1-9-25-13)6-3-11-27-17-8-7-15(21-22-17)20-18(24)14-5-2-10-26-14/h1-2,4-5,7-10H,3,6,11-12H2,(H,19,23)(H,20,21,24)