S-azanyl 4-(phenylmethyl)piperazine-1-carbothioate

Systemtic Name: S-azanyl 4-(phenylmethyl)piperazine-1-carbothioate Openeye Name: S-amino 4-benzylpiperazine-1-carbothioate CAS Name: 4-(phenylmethyl)-1-piperazinecarbothioic acid S-amino ester IUPAC Name: S-amino 4-benzylpiperazine-1-carbothioate Traditional Name: 4-benzylpiperazine-1-carbothioic acid S-amino ester Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)SN

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)SN

InChI

InChI=1S/C12H17N3OS/c13-17-12(16)15-8-6-14(7-9-15)10-11-4-2-1-3-5-11/h1-5H,6-10,13H2