1-(thian-4-yl)-4-(4-thiophen-3-yl-1,2,3-triazol-1-yl)piperidin-1-ium

Systemtic Name: 1-(thian-4-yl)-4-(4-thiophen-3-yl-1,2,3-triazol-1-yl)piperidin-1-ium Openeye Name: 1-tetrahydrothiopyran-4-yl-4-[4-(3-thienyl)triazol-1-yl]piperidin-1-ium CAS Name: 1-(4-thianyl)-4-[4-(3-thiophenyl)-1-triazolyl]piperidin-1-ium IUPAC Name: 1-(thian-4-yl)-4-(4-thiophen-3-yltriazol-1-yl)piperidin-1-ium Traditional Name: 1-tetrahydrothiopyran-4-yl-4-[4-(3-thienyl)triazol-1-yl]piperidin-1-ium Formula: C16H23N4S2+ MolecularWeight: 335.51062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=C(N=N2)C3=CSC=C3)C4CCSCC4

Isomeric SMILES

C1C[NH+](CCC1N2C=C(N=N2)C3=CSC=C3)C4CCSCC4

InChI

InChI=1S/C16H22N4S2/c1-6-19(14-4-9-21-10-5-14)7-2-15(1)20-11-16(17-18-20)13-3-8-22-12-13/h3,8,11-12,14-15H,1-2,4-7,9-10H2/p+1