1-(4-butoxyphenyl)-3-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)urea

Systemtic Name: 1-(4-butoxyphenyl)-3-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)urea Openeye Name: 1-(4-butoxyphenyl)-3-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)urea CAS Name: 1-(4-butoxyphenyl)-3-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)urea IUPAC Name: 1-(4-butoxyphenyl)-3-(1-ethylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)urea Traditional Name: 1-(4-butoxyphenyl)-3-(1-esyl-3,4-dihydro-2H-quinolin-6-yl)urea Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)N(CCC3)S(=O)(=O)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)N(CCC3)S(=O)(=O)CC

InChI

InChI=1S/C22H29N3O4S/c1-3-5-15-29-20-11-8-18(9-12-20)23-22(26)24-19-10-13-21-17(16-19)7-6-14-25(21)30(27,28)4-2/h8-13,16H,3-7,14-15H2,1-2H3,(H2,23,24,26)