1-[[4-(2-azanylethoxy)-3-methoxy-phenyl]methyl]-1-nonylsulfanyl-urea

Systemtic Name: 1-[[4-(2-azanylethoxy)-3-methoxy-phenyl]methyl]-1-nonylsulfanyl-urea Openeye Name: 1-[[4-(2-aminoethoxy)-3-methoxy-phenyl]methyl]-1-nonylsulfanyl-urea CAS Name: 1-[[4-(2-aminoethoxy)-3-methoxyphenyl]methyl]-1-(nonylthio)urea IUPAC Name: 1-[[4-(2-aminoethoxy)-3-methoxyphenyl]methyl]-1-nonylsulfanylurea Traditional Name: 1-[4-(2-aminoethoxy)-3-methoxy-benzyl]-1-(nonylthio)urea Formula: C20H35N3O3S MolecularWeight: 397.5752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCSN(CC1=CC(=C(C=C1)OCCN)OC)C(=O)N

Isomeric SMILES

CCCCCCCCCSN(CC1=CC(=C(C=C1)OCCN)OC)C(=O)N

InChI

InChI=1S/C20H35N3O3S/c1-3-4-5-6-7-8-9-14-27-23(20(22)24)16-17-10-11-18(26-13-12-21)19(15-17)25-2/h10-11,15H,3-9,12-14,16,21H2,1-2H3,(H2,22,24)