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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)SN

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)SN

InChI

InChI=1S/C12H17N3OS/c1-10-2-4-11(5-3-10)14-6-8-15(9-7-14)12(16)17-13/h2-5H,6-9,13H2,1H3