[1-(5-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]methyl thiocyanate

Systemtic Name: [1-(5-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]methyl thiocyanate Openeye Name: [1-(5-chloro-2-methyl-phenyl)-2,5-dioxo-pyrrolidin-3-yl]methyl thiocyanate CAS Name: thiocyanic acid [1-(5-chloro-2-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]methyl ester IUPAC Name: [1-(5-chloro-2-methylphenyl)-2,5-dioxopyrrolidin-3-yl]methyl thiocyanate Traditional Name: thiocyanic acid [1-(5-chloro-2-methyl-phenyl)-2,5-diketo-pyrrolidin-3-yl]methyl ester Formula: C13H11ClN2O2S MolecularWeight: 294.75664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)CSC#N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=O)CC(C2=O)CSC#N

InChI

InChI=1S/C13H11ClN2O2S/c1-8-2-3-10(14)5-11(8)16-12(17)4-9(13(16)18)6-19-7-15/h2-3,5,9H,4,6H2,1H3