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1-[(1S)-3-(azepan-1-yl)-3-oxidanylidene-1-(3-phenoxyphenyl)propyl]urea

1-[(1S)-3-(azepan-1-yl)-3-oxidanylidene-1-(3-phenoxyphenyl)propyl]urea

Systemtic Name:1-[(1S)-3-(azepan-1-yl)-3-oxidanylidene-1-(3-phenoxyphenyl)propyl]urea
Openeye Name:[(1S)-3-(azepan-1-yl)-3-oxo-1-(3-phenoxyphenyl)propyl]urea
CAS Name:[(1S)-3-(1-azepanyl)-3-oxo-1-(3-phenoxyphenyl)propyl]urea
IUPAC Name:[(1S)-3-(azepan-1-yl)-3-oxo-1-(3-phenoxyphenyl)propyl]urea
Traditional Name:[(1S)-3-(azepan-1-yl)-3-keto-1-(3-phenoxyphenyl)propyl]urea
Formula: C22H27N3O3
MolecularWeight: 381.46808
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC(C2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)N


Isomeric SMILES

C1CCCN(CC1)C(=O)C[C@@H](C2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)N


InChI

InChI=1S/C22H27N3O3/c23-22(27)24-20(16-21(26)25-13-6-1-2-7-14-25)17-9-8-12-19(15-17)28-18-10-4-3-5-11-18/h3-5,8-12,15,20H,1-2,6-7,13-14,16H2,(H3,23,24,27)/t20-/m0/s1


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