1-[(1S)-1-(3-chlorophenyl)ethyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-[(1S)-1-(3-chlorophenyl)ethyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[(1S)-1-(3-chlorophenyl)ethyl]-3-[[4-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-[(1S)-1-(3-chlorophenyl)ethyl]-3-[[4-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[(1S)-1-(3-chlorophenyl)ethyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-[(1S)-1-(3-chlorophenyl)ethyl]-3-(4-piperidinosulfonylbenzyl)urea Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)NC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)Cl)NC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26ClN3O3S/c1-16(18-6-5-7-19(22)14-18)24-21(26)23-15-17-8-10-20(11-9-17)29(27,28)25-12-3-2-4-13-25/h5-11,14,16H,2-4,12-13,15H2,1H3,(H2,23,24,26)/t16-/m0/s1