N-[6-[4-(2-methoxyethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]-3-methyl-but-2-enamide

Systemtic Name: N-[6-[4-(2-methoxyethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]-3-methyl-but-2-enamide Openeye Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide CAS Name: N-[6-[4-(2-methoxy-1-oxoethyl)-1,4-diazepan-1-yl]-3-pyridinyl]-3-methyl-2-butenamide IUPAC Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]pyridin-3-yl]-3-methylbut-2-enamide Traditional Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CN=C(C=C1)N2CCCN(CC2)C(=O)COC)C

Isomeric SMILES

CC(=CC(=O)NC1=CN=C(C=C1)N2CCCN(CC2)C(=O)COC)C

InChI

InChI=1S/C18H26N4O3/c1-14(2)11-17(23)20-15-5-6-16(19-12-15)21-7-4-8-22(10-9-21)18(24)13-25-3/h5-6,11-12H,4,7-10,13H2,1-3H3,(H,20,23)