1-[2-(phenylsulfonyl)ethyl]-3-(3-piperidin-1-ylpropyl)-1-propan-2-yl-urea

Systemtic Name: 1-[2-(phenylsulfonyl)ethyl]-3-(3-piperidin-1-ylpropyl)-1-propan-2-yl-urea Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-1-isopropyl-3-[3-(1-piperidyl)propyl]urea CAS Name: 1-[2-(benzenesulfonyl)ethyl]-3-[3-(1-piperidinyl)propyl]-1-propan-2-ylurea IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-3-(3-piperidin-1-ylpropyl)-1-propan-2-ylurea Traditional Name: 1-(2-besylethyl)-1-isopropyl-3-(3-piperidinopropyl)urea Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCCN2CCCCC2

Isomeric SMILES

CC(C)N(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCCN2CCCCC2

InChI

InChI=1S/C20H33N3O3S/c1-18(2)23(16-17-27(25,26)19-10-5-3-6-11-19)20(24)21-12-9-15-22-13-7-4-8-14-22/h3,5-6,10-11,18H,4,7-9,12-17H2,1-2H3,(H,21,24)