2-methyl-1-[2-methyl-4-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[2-methyl-4-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[2-methyl-4-[2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[2-methyl-4-[1-oxo-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[2-methyl-4-[2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[2-methyl-4-[2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]piperazino]propan-1-one Formula: C23H27N5O2S2 MolecularWeight: 469.62278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(C)C)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1CN(CCN1C(=O)C(C)C)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H27N5O2S2/c1-16(2)22(30)27-12-11-26(14-17(27)3)20(29)15-32-23-25-24-21(19-10-7-13-31-19)28(23)18-8-5-4-6-9-18/h4-10,13,16-17H,11-12,14-15H2,1-3H3