3-[4-(diethylamino)butyl]-1-[2-(phenylsulfonyl)ethyl]-1-propan-2-yl-urea

Systemtic Name: 3-[4-(diethylamino)butyl]-1-[2-(phenylsulfonyl)ethyl]-1-propan-2-yl-urea Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-3-[4-(diethylamino)butyl]-1-isopropyl-urea CAS Name: 1-[2-(benzenesulfonyl)ethyl]-3-[4-(diethylamino)butyl]-1-propan-2-ylurea IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-3-[4-(diethylamino)butyl]-1-propan-2-ylurea Traditional Name: 1-(2-besylethyl)-3-[4-(diethylamino)butyl]-1-isopropyl-urea Formula: C20H35N3O3S MolecularWeight: 397.5752

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCNC(=O)N(CCS(=O)(=O)C1=CC=CC=C1)C(C)C

Isomeric SMILES

CCN(CC)CCCCNC(=O)N(CCS(=O)(=O)C1=CC=CC=C1)C(C)C

InChI

InChI=1S/C20H35N3O3S/c1-5-22(6-2)15-11-10-14-21-20(24)23(18(3)4)16-17-27(25,26)19-12-8-7-9-13-19/h7-9,12-13,18H,5-6,10-11,14-17H2,1-4H3,(H,21,24)