1-[4-(2-azanylethyl)phenyl]sulfonyl-3-butyl-urea

Systemtic Name: 1-[4-(2-azanylethyl)phenyl]sulfonyl-3-butyl-urea Openeye Name: 1-[4-(2-aminoethyl)phenyl]sulfonyl-3-butyl-urea CAS Name: 1-[4-(2-aminoethyl)phenyl]sulfonyl-3-butylurea IUPAC Name: 1-[4-(2-aminoethyl)phenyl]sulfonyl-3-butylurea Traditional Name: 1-[4-(2-aminoethyl)phenyl]sulfonyl-3-butyl-urea Formula: C13H21N3O3S MolecularWeight: 299.38914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CCN

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)CCN

InChI

InChI=1S/C13H21N3O3S/c1-2-3-10-15-13(17)16-20(18,19)12-6-4-11(5-7-12)8-9-14/h4-7H,2-3,8-10,14H2,1H3,(H2,15,16,17)