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

Systemtic Name: N-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-methyl-but-2-enamide Openeye Name: N-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide CAS Name: N-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]-3-methyl-2-butenamide IUPAC Name: N-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-methylbut-2-enamide Traditional Name: N-[6-[4-(2,4-dimethoxybenzyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide Formula: C24H32N4O3 MolecularWeight: 424.53588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CN=C(C=C1)N2CCCN(CC2)CC3=C(C=C(C=C3)OC)OC)C

Isomeric SMILES

CC(=CC(=O)NC1=CN=C(C=C1)N2CCCN(CC2)CC3=C(C=C(C=C3)OC)OC)C

InChI

InChI=1S/C24H32N4O3/c1-18(2)14-24(29)26-20-7-9-23(25-16-20)28-11-5-10-27(12-13-28)17-19-6-8-21(30-3)15-22(19)31-4/h6-9,14-16H,5,10-13,17H2,1-4H3,(H,26,29)