N-(3-ethoxypropyl)-4-(phenylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-ethoxypropyl)-4-(phenylsulfonyl)piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-(3-ethoxypropyl)piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-(3-ethoxypropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-(3-ethoxypropyl)piperazine-1-carbothioamide Traditional Name: 4-besyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide Formula: C16H25N3O3S2 MolecularWeight: 371.518

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S2/c1-2-22-14-6-9-17-16(23)18-10-12-19(13-11-18)24(20,21)15-7-4-3-5-8-15/h3-5,7-8H,2,6,9-14H2,1H3,(H,17,23)