N-[(2,5-dimethylpyrazol-3-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(2,5-dimethyl-3-pyrazolyl)methyl]-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2,5-dimethylpyrazol-3-yl)methyl-(4-pyrrolidinosulfonylphenyl)amine Formula: C16H22N4O2S MolecularWeight: 334.43648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=NN(C(=C1)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C16H22N4O2S/c1-13-11-15(19(2)18-13)12-17-14-5-7-16(8-6-14)23(21,22)20-9-3-4-10-20/h5-8,11,17H,3-4,9-10,12H2,1-2H3