N-[3-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylpropanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[2-[[2-(4-methylanilino)-2-oxoethyl]thio]-1-oxopropyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[2-[[2-keto-2-(p-toluidino)ethyl]thio]propanoylamino]phenyl]-2-furamide Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O4S/c1-15-8-10-17(11-9-15)24-21(27)14-31-16(2)22(28)25-18-5-3-6-19(13-18)26-23(29)20-7-4-12-30-20/h3-13,16H,14H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)