1-[3-[5-(4-methoxyphenyl)-2-prop-2-ynyl-1,2,4-triazol-3-yl]phenyl]-N,N-dimethyl-methanamine

Systemtic Name: 1-[3-[5-(4-methoxyphenyl)-2-prop-2-ynyl-1,2,4-triazol-3-yl]phenyl]-N,N-dimethyl-methanamine Openeye Name: 1-[3-[5-(4-methoxyphenyl)-2-prop-2-ynyl-1,2,4-triazol-3-yl]phenyl]-N,N-dimethyl-methanamine CAS Name: 1-[3-[5-(4-methoxyphenyl)-2-prop-2-ynyl-1,2,4-triazol-3-yl]phenyl]-N,N-dimethylmethanamine IUPAC Name: 1-[3-[5-(4-methoxyphenyl)-2-prop-2-ynyl-1,2,4-triazol-3-yl]phenyl]-N,N-dimethylmethanamine Traditional Name: [3-[5-(4-methoxyphenyl)-2-propargyl-1,2,4-triazol-3-yl]benzyl]-dimethyl-amine Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC(=C1)C2=NC(=NN2CC#C)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CC1=CC=CC(=C1)C2=NC(=NN2CC#C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N4O/c1-5-13-25-21(18-8-6-7-16(14-18)15-24(2)3)22-20(23-25)17-9-11-19(26-4)12-10-17/h1,6-12,14H,13,15H2,2-4H3