(1S)-N-(2,1,3-benzothiadiazol-5-ylmethyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine

Systemtic Name: (1S)-N-(2,1,3-benzothiadiazol-5-ylmethyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine Openeye Name: (1S)-N-(2,1,3-benzothiadiazol-5-ylmethyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine CAS Name: (1S)-N-(2,1,3-benzothiadiazol-5-ylmethyl)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethanamine IUPAC Name: (1S)-N-(2,1,3-benzothiadiazol-5-ylmethyl)-1-(5-methyl-1-phenylpyrazol-4-yl)ethanamine Traditional Name: [(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]-(piazthiol-5-ylmethyl)amine Formula: C19H19N5S MolecularWeight: 349.45266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=CC4=NSN=C4C=C3

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)NCC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C19H19N5S/c1-13(20-11-15-8-9-18-19(10-15)23-25-22-18)17-12-21-24(14(17)2)16-6-4-3-5-7-16/h3-10,12-13,20H,11H2,1-2H3/t13-/m0/s1