N-[4-[[6-(azepan-1-yl)pyridin-3-yl]methylamino]-4-oxidanylidene-butyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[[6-(azepan-1-yl)pyridin-3-yl]methylamino]-4-oxidanylidene-butyl]cyclopropanecarboxamide Openeye Name: N-[4-[[6-(azepan-1-yl)-3-pyridyl]methylamino]-4-oxo-butyl]cyclopropanecarboxamide CAS Name: N-[4-[[6-(1-azepanyl)-3-pyridinyl]methylamino]-4-oxobutyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[6-(azepan-1-yl)pyridin-3-yl]methylamino]-4-oxobutyl]cyclopropanecarboxamide Traditional Name: N-[4-[[6-(azepan-1-yl)-3-pyridyl]methylamino]-4-keto-butyl]cyclopropanecarboxamide Formula: C20H30N4O2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)CCCNC(=O)C3CC3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)CCCNC(=O)C3CC3

InChI

InChI=1S/C20H30N4O2/c25-19(6-5-11-21-20(26)17-8-9-17)23-15-16-7-10-18(22-14-16)24-12-3-1-2-4-13-24/h7,10,14,17H,1-6,8-9,11-13,15H2,(H,21,26)(H,23,25)