2-oxidanylidene-5-(4-propan-2-ylphenyl)-4-sulfanyl-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile

Systemtic Name: 2-oxidanylidene-5-(4-propan-2-ylphenyl)-4-sulfanyl-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile Openeye Name: 5-(4-isopropylphenyl)-2-oxo-4-sulfanyl-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile CAS Name: 4-mercapto-2-oxo-5-(4-propan-2-ylphenyl)-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile IUPAC Name: 2-oxo-5-(4-propan-2-ylphenyl)-4-sulfanyl-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile Traditional Name: 2-keto-4-mercapto-5-p-cumenyl-1,5-diazaspiro[5.6]dodec-3-ene-3-carbonitrile Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C(=O)NC23CCCCCC3)C#N)S

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C(=O)NC23CCCCCC3)C#N)S

InChI

InChI=1S/C20H25N3OS/c1-14(2)15-7-9-16(10-8-15)23-19(25)17(13-21)18(24)22-20(23)11-5-3-4-6-12-20/h7-10,14,25H,3-6,11-12H2,1-2H3,(H,22,24)