5-bromanyl-N-[2-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[2-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[2-[2-(1,4-diazepan-1-yl)-2-oxo-ethyl]phenyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[2-[2-(1,4-diazepan-1-yl)-2-oxoethyl]phenyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[2-[2-(1,4-diazepan-1-yl)-2-keto-ethyl]phenyl]nicotinamide Formula: C19H21BrN4O2 MolecularWeight: 417.29964

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)CC2=CC=CC=C2NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CNCCN(C1)C(=O)CC2=CC=CC=C2NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C19H21BrN4O2/c20-16-10-15(12-22-13-16)19(26)23-17-5-2-1-4-14(17)11-18(25)24-8-3-6-21-7-9-24/h1-2,4-5,10,12-13,21H,3,6-9,11H2,(H,23,26)