N-[(1-methylpyrazol-4-yl)-(3-methylsulfonylphenyl)methyl]propan-1-amine

Systemtic Name: N-[(1-methylpyrazol-4-yl)-(3-methylsulfonylphenyl)methyl]propan-1-amine Openeye Name: N-[(1-methylpyrazol-4-yl)-(3-methylsulfonylphenyl)methyl]propan-1-amine CAS Name: N-[(1-methyl-4-pyrazolyl)-(3-methylsulfonylphenyl)methyl]-1-propanamine IUPAC Name: N-[(1-methylpyrazol-4-yl)-(3-methylsulfonylphenyl)methyl]propan-1-amine Traditional Name: [(3-mesylphenyl)-(1-methylpyrazol-4-yl)methyl]-propyl-amine Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C1=CC(=CC=C1)S(=O)(=O)C)C2=CN(N=C2)C

Isomeric SMILES

CCCNC(C1=CC(=CC=C1)S(=O)(=O)C)C2=CN(N=C2)C

InChI

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