3-(furan-2-ylmethyl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-(2-furylmethyl)-2-hexylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-(2-furanylmethyl)-2-(hexylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-(furan-2-ylmethyl)-2-hexylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 3-(2-furfuryl)-2-(hexylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C28H34N2O2S MolecularWeight: 462.64676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCCC4)CC5=CC=CC=C52

Isomeric SMILES

CCCCCCSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCCC4)CC5=CC=CC=C52

InChI

InChI=1S/C28H34N2O2S/c1-2-3-4-10-18-33-27-29-25-23-14-7-6-12-21(23)19-28(15-8-5-9-16-28)24(25)26(31)30(27)20-22-13-11-17-32-22/h6-7,11-14,17H,2-5,8-10,15-16,18-20H2,1H3