N-(3-cyanophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(3-cyanophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(3-cyanophenyl)-2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(3-cyanophenyl)-2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(3-cyanophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(3-cyanophenyl)-2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]benzamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#N)SCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C#N)SCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H17N3O3S/c22-12-15-5-3-6-16(11-15)24-21(26)18-8-1-2-9-19(18)28-14-20(25)23-13-17-7-4-10-27-17/h1-11H,13-14H2,(H,23,25)(H,24,26)