4-phenethyl-2-prop-2-enylsulfanyl-spiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]-3-one

Systemtic Name: 4-phenethyl-2-prop-2-enylsulfanyl-spiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]-3-one Openeye Name: 2-allylsulfanyl-4-phenethyl-spiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]-3-one CAS Name: 4-phenethyl-2-(prop-2-enylthio)-3-spiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]one IUPAC Name: 4-phenethyl-2-prop-2-enylsulfanylspiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]-3-one Traditional Name: 2-(allylthio)-4-phenethyl-spiro[6H-benzo[f]quinoxaline-5,1'-cyclohexane]-3-one Formula: C28H30N2OS MolecularWeight: 442.6156

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C3(CCCCC3)CC4=CC=CC=C42)N(C1=O)CCC5=CC=CC=C5

Isomeric SMILES

C=CCSC1=NC2=C(C3(CCCCC3)CC4=CC=CC=C42)N(C1=O)CCC5=CC=CC=C5

InChI

InChI=1S/C28H30N2OS/c1-2-19-32-26-27(31)30(18-15-21-11-5-3-6-12-21)25-24(29-26)23-14-8-7-13-22(23)20-28(25)16-9-4-10-17-28/h2-3,5-8,11-14H,1,4,9-10,15-20H2