3-methyl-5-[methyl(thiolan-3-yl)amino]-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-methyl-5-[methyl(thiolan-3-yl)amino]-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 3-methyl-5-[methyl(tetrahydrothiophen-3-yl)amino]-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-methyl-5-[methyl(3-thiolanyl)amino]-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-methyl-5-[methyl(thiolan-3-yl)amino]-1-phenylpyrazole-4-carbaldehyde Traditional Name: 3-methyl-5-[methyl(tetrahydrothiophen-3-yl)amino]-1-phenyl-pyrazole-4-carbaldehyde Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)N(C)C2CCSC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=O)N(C)C2CCSC2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c1-12-15(10-20)16(18(2)14-8-9-21-11-14)19(17-12)13-6-4-3-5-7-13/h3-7,10,14H,8-9,11H2,1-2H3