1,1-bis(2-dimethylaminoethyl)-3-[2-(phenylsulfonyl)ethyl]-3-propan-2-yl-urea

Systemtic Name: 1,1-bis(2-dimethylaminoethyl)-3-[2-(phenylsulfonyl)ethyl]-3-propan-2-yl-urea Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-3,3-bis(2-dimethylaminoethyl)-1-isopropyl-urea CAS Name: 1-[2-(benzenesulfonyl)ethyl]-3,3-bis(2-dimethylaminoethyl)-1-propan-2-ylurea IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-3,3-bis(2-dimethylaminoethyl)-1-propan-2-ylurea Traditional Name: 1-(2-besylethyl)-3,3-bis(2-dimethylaminoethyl)-1-isopropyl-urea Formula: C20H36N4O3S MolecularWeight: 412.58984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36N4O3S/c1-18(2)24(16-17-28(26,27)19-10-8-7-9-11-19)20(25)23(14-12-21(3)4)15-13-22(5)6/h7-11,18H,12-17H2,1-6H3