4-(phenylmethyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide

Systemtic Name: 4-(phenylmethyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-benzylsulfonyl-piperazine-1-carbothioamide CAS Name: 4-(phenylmethyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-benzylsulfonyl-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-benzylsulfonyl-piperazine-1-carbothioamide Formula: C15H21N3O2S2 MolecularWeight: 339.47614

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H21N3O2S2/c1-2-8-16-15(21)17-9-11-18(12-10-17)22(19,20)13-14-6-4-3-5-7-14/h2-7H,1,8-13H2,(H,16,21)