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

Systemtic Name: 1-propan-2-yl-3-[6-[4-[(4-propan-2-ylphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]urea Openeye Name: 1-isopropyl-3-[6-[4-[(4-isopropylphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]urea CAS Name: 1-propan-2-yl-3-[6-[4-[(4-propan-2-ylphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]urea IUPAC Name: 1-propan-2-yl-3-[6-[4-[(4-propan-2-ylphenyl)methyl]-1,4-diazepan-1-yl]pyridin-3-yl]urea Traditional Name: 1-isopropyl-3-[6-[4-(4-isopropylbenzyl)-1,4-diazepan-1-yl]-3-pyridyl]urea Formula: C24H35N5O MolecularWeight: 409.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC=C(C=C3)NC(=O)NC(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCCN(CC2)C3=NC=C(C=C3)NC(=O)NC(C)C

InChI

InChI=1S/C24H35N5O/c1-18(2)21-8-6-20(7-9-21)17-28-12-5-13-29(15-14-28)23-11-10-22(16-25-23)27-24(30)26-19(3)4/h6-11,16,18-19H,5,12-15,17H2,1-4H3,(H2,26,27,30)