N-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-1,4-diazepane-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-1,4-diazepane-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-1,4-diazepane-1-carbothioamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-methyl-1,4-diazepane-1-carbothioamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-methyl-1,4-diazepane-1-carbothioamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-methyl-1,4-diazepane-1-carbothioamide Formula: C15H22ClN3S2 MolecularWeight: 343.93828

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=S)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CN1CCCN(CC1)C(=S)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H22ClN3S2/c1-18-8-2-9-19(11-10-18)15(20)17-7-12-21-14-5-3-13(16)4-6-14/h3-6H,2,7-12H2,1H3,(H,17,20)