(3-methoxy-4-phenylmethoxy-phenyl)-(4-phenylpiperazin-1-yl)methanethione

Systemtic Name: (3-methoxy-4-phenylmethoxy-phenyl)-(4-phenylpiperazin-1-yl)methanethione Openeye Name: (4-benzyloxy-3-methoxy-phenyl)-(4-phenylpiperazin-1-yl)methanethione CAS Name: (3-methoxy-4-phenylmethoxyphenyl)-(4-phenyl-1-piperazinyl)methanethione IUPAC Name: (3-methoxy-4-phenylmethoxyphenyl)-(4-phenylpiperazin-1-yl)methanethione Traditional Name: (4-benzoxy-3-methoxy-phenyl)-(4-phenylpiperazino)methanethione Formula: C25H26N2O2S MolecularWeight: 418.55114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)N2CCN(CC2)C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O2S/c1-28-24-18-21(12-13-23(24)29-19-20-8-4-2-5-9-20)25(30)27-16-14-26(15-17-27)22-10-6-3-7-11-22/h2-13,18H,14-17,19H2,1H3