S-[[4-(phenylcarbamoyloxy)phenyl]methyl] piperazine-1-carbothioate hydrochloride

Systemtic Name: S-[[4-(phenylcarbamoyloxy)phenyl]methyl] piperazine-1-carbothioate hydrochloride Openeye Name: S-[[4-(phenylcarbamoyloxy)phenyl]methyl] piperazine-1-carbothioate hydrochloride CAS Name: 1-piperazinecarbothioic acid S-[[4-[anilino(oxo)methoxy]phenyl]methyl] ester hydrochloride IUPAC Name: S-[[4-(phenylcarbamoyloxy)phenyl]methyl] piperazine-1-carbothioate hydrochloride Traditional Name: piperazine-1-carbothioic acid S-[4-(phenylcarbamoyloxy)benzyl] ester hydrochloride Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)SCC2=CC=C(C=C2)OC(=O)NC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCN1)C(=O)SCC2=CC=C(C=C2)OC(=O)NC3=CC=CC=C3.Cl

InChI

InChI=1S/C19H21N3O3S.ClH/c23-18(21-16-4-2-1-3-5-16)25-17-8-6-15(7-9-17)14-26-19(24)22-12-10-20-11-13-22;/h1-9,20H,10-14H2,(H,21,23);1H