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

Systemtic Name: N-[6-[4-(cycloheptylamino)-4-oxidanylidene-butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Openeye Name: N-[6-[4-(cycloheptylamino)-4-oxo-butyl]sulfanylpyridazin-3-yl]furan-2-carboxamide CAS Name: N-[6-[[4-(cycloheptylamino)-4-oxobutyl]thio]-3-pyridazinyl]-2-furancarboxamide IUPAC Name: N-[6-[4-(cycloheptylamino)-4-oxobutyl]sulfanylpyridazin-3-yl]furan-2-carboxamide Traditional Name: N-[6-[[4-(cycloheptylamino)-4-keto-butyl]thio]pyridazin-3-yl]-2-furamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H26N4O3S/c25-18(21-15-7-3-1-2-4-8-15)10-6-14-28-19-12-11-17(23-24-19)22-20(26)16-9-5-13-27-16/h5,9,11-13,15H,1-4,6-8,10,14H2,(H,21,25)(H,22,23,26)