N-(2-azanylethyl)-4-[5-(azepan-1-yl)-2-oxidanylidene-pyridin-1-yl]butanamide

Systemtic Name: N-(2-azanylethyl)-4-[5-(azepan-1-yl)-2-oxidanylidene-pyridin-1-yl]butanamide Openeye Name: N-(2-aminoethyl)-4-[5-(azepan-1-yl)-2-oxo-1-pyridyl]butanamide CAS Name: N-(2-aminoethyl)-4-[5-(1-azepanyl)-2-oxo-1-pyridinyl]butanamide IUPAC Name: N-(2-aminoethyl)-4-[5-(azepan-1-yl)-2-oxopyridin-1-yl]butanamide Traditional Name: N-(2-aminoethyl)-4-[5-(azepan-1-yl)-2-keto-1-pyridyl]butyramide Formula: C17H28N4O2 MolecularWeight: 320.42982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CN(C(=O)C=C2)CCCC(=O)NCCN

Isomeric SMILES

C1CCCN(CC1)C2=CN(C(=O)C=C2)CCCC(=O)NCCN

InChI

InChI=1S/C17H28N4O2/c18-9-10-19-16(22)6-5-13-21-14-15(7-8-17(21)23)20-11-3-1-2-4-12-20/h7-8,14H,1-6,9-13,18H2,(H,19,22)