(4-butoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(5-thiophen-2-yl-6H-1,3,4-thiadiazin-2-yl)piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-[5-(2-thienyl)-6H-1,3,4-thiadiazin-2-yl]piperazino]methanone Formula: C22H26N4O2S2 MolecularWeight: 442.59744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(CS3)C4=CC=CS4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(CS3)C4=CC=CS4

InChI

InChI=1S/C22H26N4O2S2/c1-2-3-14-28-18-8-6-17(7-9-18)21(27)25-10-12-26(13-11-25)22-24-23-19(16-30-22)20-5-4-15-29-20/h4-9,15H,2-3,10-14,16H2,1H3