N-[4-(azepan-1-ylsulfonyl)phenyl]-4,6-dimethyl-pyrimidin-2-amine

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4,6-dimethyl-pyrimidin-2-amine Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4,6-dimethyl-pyrimidin-2-amine CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4,6-dimethyl-2-pyrimidinamine IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4,6-dimethylpyrimidin-2-amine Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-(4,6-dimethylpyrimidin-2-yl)amine Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C18H24N4O2S/c1-14-13-15(2)20-18(19-14)21-16-7-9-17(10-8-16)25(23,24)22-11-5-3-4-6-12-22/h7-10,13H,3-6,11-12H2,1-2H3,(H,19,20,21)