[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-(1-thiophen-3-ylcarbonylpiperidin-4-yl)methanone

Systemtic Name: [2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-(1-thiophen-3-ylcarbonylpiperidin-4-yl)methanone Openeye Name: [2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-[1-(thiophene-3-carbonyl)-4-piperidyl]methanone CAS Name: [2-(cyclohexylamino)-4-methyl-1-pyridin-1-iumyl]-[1-[oxo(3-thiophenyl)methyl]-4-piperidinyl]methanone IUPAC Name: [2-(cyclohexylamino)-4-methylpyridin-1-ium-1-yl]-[1-(thiophene-3-carbonyl)piperidin-4-yl]methanone Traditional Name: [2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-[1-(3-thenoyl)-4-piperidyl]methanone Formula: C23H30N3O2S+ MolecularWeight: 412.5682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)C(=O)C2CCN(CC2)C(=O)C3=CSC=C3)NC4CCCCC4

Isomeric SMILES

CC1=CC(=[N+](C=C1)C(=O)C2CCN(CC2)C(=O)C3=CSC=C3)NC4CCCCC4

InChI

InChI=1S/C23H29N3O2S/c1-17-7-13-26(21(15-17)24-20-5-3-2-4-6-20)23(28)18-8-11-25(12-9-18)22(27)19-10-14-29-16-19/h7,10,13-16,18,20H,2-6,8-9,11-12H2,1H3/p+1