N-[1-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[1-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[1-[2-[(2-cyanophenyl)methylsulfanyl]ethylcarbamoyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[1-[2-[(2-cyanophenyl)methylthio]ethylamino]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[1-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[1-[2-[(2-cyanobenzyl)thio]ethylcarbamoyl]-2-methyl-propyl]-2-furamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSCC1=CC=CC=C1C#N)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)C(C(=O)NCCSCC1=CC=CC=C1C#N)NC(=O)C2=CC=CO2

InChI

InChI=1S/C20H23N3O3S/c1-14(2)18(23-19(24)17-8-5-10-26-17)20(25)22-9-11-27-13-16-7-4-3-6-15(16)12-21/h3-8,10,14,18H,9,11,13H2,1-2H3,(H,22,25)(H,23,24)