4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-(2-furylmethyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-(2-furanylmethyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-(furan-2-ylmethyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-(2-furfuryl)amino]methyl]-N-methyl-benzamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C21H20N4O3S/c1-23-20(27)16-6-4-15(5-7-16)12-25(13-18-3-2-9-28-18)14-19(26)24-21-17(11-22)8-10-29-21/h2-10H,12-14H2,1H3,(H,23,27)(H,24,26)