N-(5-morpholin-4-ylsulfonylpyridin-2-yl)-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-amine

Systemtic Name: N-(5-morpholin-4-ylsulfonylpyridin-2-yl)-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-amine Openeye Name: N-(5-morpholinosulfonyl-2-pyridyl)-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-amine CAS Name: N-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-amine IUPAC Name: N-(5-morpholin-4-ylsulfonylpyridin-2-yl)-7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-amine Traditional Name: (5-morpholinosulfonyl-2-pyridyl)-(7,8,9,10-tetrahydro-6H-azepino[1,2-a]benzimidazol-3-yl)amine Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(N2CC1)C=CC(=C3)NC4=NC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

C1CCC2=NC3=C(N2CC1)C=CC(=C3)NC4=NC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C21H25N5O3S/c27-30(28,25-10-12-29-13-11-25)17-6-8-20(22-15-17)23-16-5-7-19-18(14-16)24-21-4-2-1-3-9-26(19)21/h5-8,14-15H,1-4,9-13H2,(H,22,23)