[2-oxidanylidene-2-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-oxidanylidene-2-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-oxo-2-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-oxo-2-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]ethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-keto-2-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]ethyl] ester Formula: C14H22N4OS3 MolecularWeight: 358.54568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)N1CCCN(CC1)CC2=NC=CS2

Isomeric SMILES

CN(C)C(=S)SCC(=O)N1CCCN(CC1)CC2=NC=CS2

InChI

InChI=1S/C14H22N4OS3/c1-16(2)14(20)22-11-13(19)18-6-3-5-17(7-8-18)10-12-15-4-9-21-12/h4,9H,3,5-8,10-11H2,1-2H3