3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]-1-[2-(phenylsulfonyl)ethyl]urea

Systemtic Name: 3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]-1-[2-(phenylsulfonyl)ethyl]urea Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]urea CAS Name: 1-[2-(benzenesulfonyl)ethyl]-3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]urea IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]urea Traditional Name: 1-(2-besylethyl)-3-(2-diethylaminoethyl)-1-[3-(diethylamino)propyl]urea Formula: C22H40N4O3S MolecularWeight: 440.643

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCN(CC)CC

Isomeric SMILES

CCN(CC)CCCN(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NCCN(CC)CC

InChI

InChI=1S/C22H40N4O3S/c1-5-24(6-2)16-12-17-26(22(27)23-15-18-25(7-3)8-4)19-20-30(28,29)21-13-10-9-11-14-21/h9-11,13-14H,5-8,12,15-20H2,1-4H3,(H,23,27)