N-(5-chloranylpyridin-2-yl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propanamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propanamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propanamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]propionamide Formula: C19H22ClFN4O3S MolecularWeight: 440.919383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)Cl)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1=NC=C(C=C1)Cl)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H22ClFN4O3S/c1-14(19(26)23-18-8-3-15(20)13-22-18)24-9-2-10-25(12-11-24)29(27,28)17-6-4-16(21)5-7-17/h3-8,13-14H,2,9-12H2,1H3,(H,22,23,26)