N-[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-N'-cyclopentyl-ethanediamide

Systemtic Name: N-[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-N'-cyclopentyl-ethanediamide Openeye Name: N-[2-[4-(azepan-1-yl)anilino]-2-oxo-ethyl]-N'-cyclopentyl-oxamide CAS Name: N-[2-[4-(1-azepanyl)anilino]-2-oxoethyl]-N'-cyclopentyloxamide IUPAC Name: N-[2-[4-(azepan-1-yl)anilino]-2-oxoethyl]-N'-cyclopentyloxamide Traditional Name: N-[2-[4-(azepan-1-yl)anilino]-2-keto-ethyl]-N'-cyclopentyl-oxamide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC(=O)C(=O)NC3CCCC3

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CNC(=O)C(=O)NC3CCCC3

InChI

InChI=1S/C21H30N4O3/c26-19(15-22-20(27)21(28)24-16-7-3-4-8-16)23-17-9-11-18(12-10-17)25-13-5-1-2-6-14-25/h9-12,16H,1-8,13-15H2,(H,22,27)(H,23,26)(H,24,28)