S-ethyl 2-ethyl-3-[2-(methylamino)-5-naphthalen-1-yl-4-oxidanylidene-furan-3-yl]benzenecarbothioate

Systemtic Name: S-ethyl 2-ethyl-3-[2-(methylamino)-5-naphthalen-1-yl-4-oxidanylidene-furan-3-yl]benzenecarbothioate Openeye Name: S-ethyl 2-ethyl-3-[2-(methylamino)-5-(1-naphthyl)-4-oxo-3-furyl]benzenecarbothioate CAS Name: 2-ethyl-3-[2-(methylamino)-5-(1-naphthalenyl)-4-oxo-3-furanyl]benzenecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 2-ethyl-3-[2-(methylamino)-5-naphthalen-1-yl-4-oxofuran-3-yl]benzenecarbothioate Traditional Name: 2-ethyl-3-[4-keto-2-(methylamino)-5-(1-naphthyl)-3-furyl]thiobenzoic acid S-ethyl ester Formula: C26H25NO3S MolecularWeight: 431.5466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1C(=O)SCC)C2=C(OC(C2=O)C3=CC=CC4=CC=CC=C43)NC

Isomeric SMILES

CCC1=C(C=CC=C1C(=O)SCC)C2=C(OC(C2=O)C3=CC=CC4=CC=CC=C43)NC

InChI

InChI=1S/C26H25NO3S/c1-4-17-19(13-9-15-21(17)26(29)31-5-2)22-23(28)24(30-25(22)27-3)20-14-8-11-16-10-6-7-12-18(16)20/h6-15,24,27H,4-5H2,1-3H3