2-(1,3-benzothiazol-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine CAS Name: 2-(1,3-benzothiazol-2-yl)-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]ethanamine IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine Traditional Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amine Formula: C16H20N4S MolecularWeight: 300.4218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CNCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=NN1C)C)CNCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H20N4S/c1-11-13(12(2)20(3)19-11)10-17-9-8-16-18-14-6-4-5-7-15(14)21-16/h4-7,17H,8-10H2,1-3H3