3-methyl-5-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]-1-phenyl-thieno[2,3-c]pyrazole

Systemtic Name: 3-methyl-5-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]-1-phenyl-thieno[2,3-c]pyrazole Openeye Name: 3-methyl-5-[4-methyl-5-[2-(1-piperidyl)ethylsulfanyl]-1,2,4-triazol-3-yl]-1-phenyl-thieno[2,3-c]pyrazole CAS Name: 3-methyl-5-[4-methyl-5-[2-(1-piperidinyl)ethylthio]-1,2,4-triazol-3-yl]-1-phenylthieno[2,3-c]pyrazole IUPAC Name: 3-methyl-5-[4-methyl-5-(2-piperidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]-1-phenylthieno[2,3-c]pyrazole Traditional Name: 3-methyl-5-[4-methyl-5-(2-piperidinoethylthio)-1,2,4-triazol-3-yl]-1-phenyl-thieno[2,3-c]pyrazole Formula: C22H26N6S2 MolecularWeight: 438.61204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C3=NN=C(N3C)SCCN4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C3=NN=C(N3C)SCCN4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C22H26N6S2/c1-16-18-15-19(30-21(18)28(25-16)17-9-5-3-6-10-17)20-23-24-22(26(20)2)29-14-13-27-11-7-4-8-12-27/h3,5-6,9-10,15H,4,7-8,11-14H2,1-2H3