1-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-propan-2-yl-urea Openeye Name: 1-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-3-isopropyl-urea CAS Name: 1-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]-3-propan-2-ylurea IUPAC Name: 1-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]-3-propan-2-ylurea Traditional Name: 1-[6-[4-(2,4-dimethoxybenzyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-isopropyl-urea Formula: C23H33N5O3 MolecularWeight: 427.53982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N5O3/c1-17(2)25-23(29)26-19-7-9-22(24-15-19)28-11-5-10-27(12-13-28)16-18-6-8-20(30-3)14-21(18)31-4/h6-9,14-15,17H,5,10-13,16H2,1-4H3,(H2,25,26,29)