methyl N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]carbamodithioate

Systemtic Name: methyl N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]carbamodithioate Openeye Name: methyl N-[3-(4-benzylpiperazin-1-yl)propyl]carbamodithioate CAS Name: N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]carbamodithioic acid methyl ester IUPAC Name: methyl N-[3-(4-benzylpiperazin-1-yl)propyl]carbamodithioate Traditional Name: N-[3-(4-benzylpiperazino)propyl]carbamodithioic acid methyl ester Formula: C16H25N3S2 MolecularWeight: 323.5198

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)NCCCN1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CSC(=S)NCCCN1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H25N3S2/c1-21-16(20)17-8-5-9-18-10-12-19(13-11-18)14-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3,(H,17,20)