methyl 4-[4-(3-methoxyphenyl)sulfanylphenyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[4-(3-methoxyphenyl)sulfanylphenyl]piperazine-1-carboxylate Openeye Name: methyl 4-[4-(3-methoxyphenyl)sulfanylphenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(3-methoxyphenyl)thio]phenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-(3-methoxyphenyl)sulfanylphenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(3-methoxyphenyl)thio]phenyl]piperazine-1-carboxylic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

Isomeric SMILES

COC1=CC(=CC=C1)SC2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

InChI

InChI=1S/C19H22N2O3S/c1-23-16-4-3-5-18(14-16)25-17-8-6-15(7-9-17)20-10-12-21(13-11-20)19(22)24-2/h3-9,14H,10-13H2,1-2H3