N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-chloranyl-pyridine-2-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-chloranyl-pyridine-2-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-chloro-pyridine-2-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-chloro-2-pyridinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-chloropyridine-2-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-chloro-picolinamide Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC=CC(=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC=CC(=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H22ClN3O3S/c1-14-6-7-16(22-19(24)17-12-15(20)8-9-21-17)13-18(14)27(25,26)23-10-4-2-3-5-11-23/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,24)