N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]-4-methylsulfonyl-aniline

Systemtic Name: N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]-4-methylsulfonyl-aniline Openeye Name: N-[(3-isopropyl-1-methyl-pyrazol-4-yl)methyl]-4-methylsulfonyl-aniline CAS Name: N-[(1-methyl-3-propan-2-yl-4-pyrazolyl)methyl]-4-methylsulfonylaniline IUPAC Name: N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]-4-methylsulfonylaniline Traditional Name: (3-isopropyl-1-methyl-pyrazol-4-yl)methyl-(4-mesylphenyl)amine Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C1CNC2=CC=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CC(C)C1=NN(C=C1CNC2=CC=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C15H21N3O2S/c1-11(2)15-12(10-18(3)17-15)9-16-13-5-7-14(8-6-13)21(4,19)20/h5-8,10-11,16H,9H2,1-4H3