2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione CAS Name: 2-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-[(E)-styryl]-1H-1,2,4-triazole-3-thione Formula: C17H23N4S+ MolecularWeight: 315.45632

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)N=C(N2)C=CC3=CC=CC=C3

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)N=C(N2)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H22N4S/c1-14-9-11-20(12-10-14)13-21-17(22)18-16(19-21)8-7-15-5-3-2-4-6-15/h2-8,14H,9-13H2,1H3,(H,18,19,22)/p+1/b8-7+