[4-[4-(5-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]phenyl] thiocyanate

Systemtic Name: [4-[4-(5-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]phenyl] thiocyanate Openeye Name: [4-[4-(5-methyl-4-oxo-2-thioxo-thiazolidin-3-yl)butanoylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[4-(5-methyl-4-oxo-2-sulfanylidene-3-thiazolidinyl)-1-oxobutyl]amino]phenyl] ester IUPAC Name: [4-[4-(5-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[4-(4-keto-5-methyl-2-thioxo-thiazolidin-3-yl)butanoylamino]phenyl] ester Formula: C15H15N3O2S3 MolecularWeight: 365.4935

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(=S)S1)CCCC(=O)NC2=CC=C(C=C2)SC#N

Isomeric SMILES

CC1C(=O)N(C(=S)S1)CCCC(=O)NC2=CC=C(C=C2)SC#N

InChI

InChI=1S/C15H15N3O2S3/c1-10-14(20)18(15(21)23-10)8-2-3-13(19)17-11-4-6-12(7-5-11)22-9-16/h4-7,10H,2-3,8H2,1H3,(H,17,19)