[2-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-[4-(2-furylmethyl)-1,4-diazepan-1-yl]-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-[4-(2-furanylmethyl)-1,4-diazepan-1-yl]-2-oxoethyl] ester IUPAC Name: [2-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-2-oxoethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-[4-(2-furfuryl)-1,4-diazepan-1-yl]-2-keto-ethyl] ester Formula: C15H23N3O2S2 MolecularWeight: 341.49202

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)N1CCCN(CC1)CC2=CC=CO2

Isomeric SMILES

CN(C)C(=S)SCC(=O)N1CCCN(CC1)CC2=CC=CO2

InChI

InChI=1S/C15H23N3O2S2/c1-16(2)15(21)22-12-14(19)18-7-4-6-17(8-9-18)11-13-5-3-10-20-13/h3,5,10H,4,6-9,11-12H2,1-2H3