2-[3-[(2,5-dimethylpyrazol-3-yl)methyl]-1-benzothiophen-2-yl]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[3-[(2,5-dimethylpyrazol-3-yl)methyl]-1-benzothiophen-2-yl]-N,N-dimethyl-ethanamine Openeye Name: 2-[3-[(2,5-dimethylpyrazol-3-yl)methyl]benzothiophen-2-yl]-N,N-dimethyl-ethanamine CAS Name: 2-[3-[(2,5-dimethyl-3-pyrazolyl)methyl]-1-benzothiophen-2-yl]-N,N-dimethylethanamine IUPAC Name: 2-[3-[(2,5-dimethylpyrazol-3-yl)methyl]-1-benzothiophen-2-yl]-N,N-dimethylethanamine Traditional Name: 2-[3-[(2,5-dimethylpyrazol-3-yl)methyl]benzothiophen-2-yl]ethyl-dimethyl-amine Formula: C18H23N3S MolecularWeight: 313.46032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CC2=C(SC3=CC=CC=C32)CCN(C)C)C

Isomeric SMILES

CC1=NN(C(=C1)CC2=C(SC3=CC=CC=C32)CCN(C)C)C

InChI

InChI=1S/C18H23N3S/c1-13-11-14(21(4)19-13)12-16-15-7-5-6-8-17(15)22-18(16)9-10-20(2)3/h5-8,11H,9-10,12H2,1-4H3