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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N5O3/c1-17(2)25-23(29)26-19-9-10-21(24-15-19)28-12-6-11-27(13-14-28)16-18-7-5-8-20(30-3)22(18)31-4/h5,7-10,15,17H,6,11-14,16H2,1-4H3,(H2,25,26,29)