5-(4-methoxyphenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile

Systemtic Name: 5-(4-methoxyphenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Openeye Name: 5-(4-methoxybenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile CAS Name: 5-[(4-methoxyphenyl)-oxomethyl]-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carbonitrile IUPAC Name: 5-(4-methoxybenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Traditional Name: 6-(methylthio)-5-p-anisoyl-2,3-dihydro-1H-pyrrolizine-1-carbonitrile Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C#N)SC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C#N)SC

InChI

InChI=1S/C17H16N2O2S/c1-21-13-5-3-11(4-6-13)17(20)16-15(22-2)9-14-12(10-18)7-8-19(14)16/h3-6,9,12H,7-8H2,1-2H3