11-(2-methoxyphenyl)-4-(5-methylfuran-2-yl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile

Systemtic Name: 11-(2-methoxyphenyl)-4-(5-methylfuran-2-yl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile Openeye Name: 11-(2-methoxyphenyl)-4-(5-methyl-2-furyl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile CAS Name: 10-mercapto-11-(2-methoxyphenyl)-4-(5-methyl-2-furanyl)-8-oxo-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile IUPAC Name: 11-(2-methoxyphenyl)-4-(5-methylfuran-2-yl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile Traditional Name: 8-keto-10-mercapto-11-(2-methoxyphenyl)-4-(5-methyl-2-furyl)-7,11-diazaspiro[5.5]undec-9-ene-9-carbonitrile Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2CCCC3(C2)NC(=O)C(=C(N3C4=CC=CC=C4OC)S)C#N

Isomeric SMILES

CC1=CC=C(O1)C2CCCC3(C2)NC(=O)C(=C(N3C4=CC=CC=C4OC)S)C#N

InChI

InChI=1S/C22H23N3O3S/c1-14-9-10-18(28-14)15-6-5-11-22(12-15)24-20(26)16(13-23)21(29)25(22)17-7-3-4-8-19(17)27-2/h3-4,7-10,15,29H,5-6,11-12H2,1-2H3,(H,24,26)