N1-phenyl-N3-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)benzene-1,3-diamine

Systemtic Name: N1-phenyl-N3-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)benzene-1,3-diamine Openeye Name: N1-phenyl-N3-(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)benzene-1,3-diamine CAS Name: N1-phenyl-N3-[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]benzene-1,3-diamine IUPAC Name: 1-N-phenyl-3-N-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)benzene-1,3-diamine Traditional Name: (3-anilinophenyl)-(5-pyrrolidinosulfonyl-2-pyridyl)amine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NC3=CC=CC(=C3)NC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NC3=CC=CC(=C3)NC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c26-28(27,25-13-4-5-14-25)20-11-12-21(22-16-20)24-19-10-6-9-18(15-19)23-17-7-2-1-3-8-17/h1-3,6-12,15-16,23H,4-5,13-14H2,(H,22,24)