3-[(4-phenylpiperazin-1-yl)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[(4-phenylpiperazin-1-yl)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-[(4-phenylpiperazin-1-yl)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[(4-phenyl-1-piperazinyl)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[(4-phenylpiperazin-1-yl)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[(4-phenylpiperazino)methyl]-5-(3,4,5-triethoxyphenyl)-1,3,4-oxadiazole-2-thione Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C2=NN(C(=S)O2)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C2=NN(C(=S)O2)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O4S/c1-4-30-21-16-19(17-22(31-5-2)23(21)32-6-3)24-26-29(25(34)33-24)18-27-12-14-28(15-13-27)20-10-8-7-9-11-20/h7-11,16-17H,4-6,12-15,18H2,1-3H3