N-[3-[2-[(4-methylphenyl)methylsulfanyl]ethanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[2-[(4-methylphenyl)methylsulfanyl]ethanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[2-(p-tolylmethylsulfanyl)acetyl]amino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[2-[(4-methylphenyl)methylthio]-1-oxoethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[[2-[(4-methylphenyl)methylsulfanyl]acetyl]amino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[[2-[(4-methylbenzyl)thio]acetyl]amino]phenyl]-2-furamide Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H20N2O3S/c1-15-7-9-16(10-8-15)13-27-14-20(24)22-17-4-2-5-18(12-17)23-21(25)19-6-3-11-26-19/h2-12H,13-14H2,1H3,(H,22,24)(H,23,25)