1-[[4,5-bis(butylsulfonyl)-2-methyl-phenyl]amino]-3-(3-dodecoxypropyl)urea

Systemtic Name: 1-[[4,5-bis(butylsulfonyl)-2-methyl-phenyl]amino]-3-(3-dodecoxypropyl)urea Openeye Name: 1-[4,5-bis(butylsulfonyl)-2-methyl-anilino]-3-(3-dodecoxypropyl)urea CAS Name: 1-[4,5-bis(butylsulfonyl)-2-methylanilino]-3-(3-dodecoxypropyl)urea IUPAC Name: 1-[4,5-bis(butylsulfonyl)-2-methylanilino]-3-(3-dodecoxypropyl)urea Traditional Name: 1-[4,5-bis(butylsulfonyl)-2-methyl-anilino]-3-(3-lauryloxypropyl)urea Formula: C31H57N3O6S2 MolecularWeight: 631.93078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCCCNC(=O)NNC1=CC(=C(C=C1C)S(=O)(=O)CCCC)S(=O)(=O)CCCC

Isomeric SMILES

CCCCCCCCCCCCOCCCNC(=O)NNC1=CC(=C(C=C1C)S(=O)(=O)CCCC)S(=O)(=O)CCCC

InChI

InChI=1S/C31H57N3O6S2/c1-5-8-11-12-13-14-15-16-17-18-21-40-22-19-20-32-31(35)34-33-28-26-30(42(38,39)24-10-7-3)29(25-27(28)4)41(36,37)23-9-6-2/h25-26,33H,5-24H2,1-4H3,(H2,32,34,35)