4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(3S)-1,1-dioxothiolan-3-yl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(3S)-1,1-dioxo-3-thiolanyl]-N-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(3S)-1,1-dioxothiolan-3-yl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(3S)-1,1-diketothiolan-3-yl]-N-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C16H23N3O3S2 MolecularWeight: 369.50212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)C3CCS(=O)(=O)C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCN(CC2)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C16H23N3O3S2/c1-22-15-4-2-3-13(11-15)17-16(23)19-8-6-18(7-9-19)14-5-10-24(20,21)12-14/h2-4,11,14H,5-10,12H2,1H3,(H,17,23)/t14-/m0/s1