methyl-[1-[4-(2-methylimidazol-1-yl)phenyl]piperidin-4-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[1-[4-(2-methylimidazol-1-yl)phenyl]piperidin-4-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[1-[4-(2-methylimidazol-1-yl)phenyl]-4-piperidyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[1-[4-(2-methyl-1-imidazolyl)phenyl]-4-piperidinyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[1-[4-(2-methylimidazol-1-yl)phenyl]piperidin-4-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: methyl-[1-[4-(2-methylimidazol-1-yl)phenyl]-4-piperidyl]-(3-thenyl)ammonium Formula: C21H27N4S+ MolecularWeight: 367.53088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)N3CCC(CC3)[NH+](C)CC4=CSC=C4

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)N3CCC(CC3)[NH+](C)CC4=CSC=C4

InChI

InChI=1S/C21H26N4S/c1-17-22-10-13-25(17)21-5-3-20(4-6-21)24-11-7-19(8-12-24)23(2)15-18-9-14-26-16-18/h3-6,9-10,13-14,16,19H,7-8,11-12,15H2,1-2H3/p+1