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

Systemtic Name: 1-[4-(aminomethyl)phenyl]sulfonyl-3-butyl-urea Openeye Name: 1-[4-(aminomethyl)phenyl]sulfonyl-3-butyl-urea CAS Name: 1-[4-(aminomethyl)phenyl]sulfonyl-3-butylurea IUPAC Name: 1-[4-(aminomethyl)phenyl]sulfonyl-3-butylurea Traditional Name: 1-[4-(aminomethyl)phenyl]sulfonyl-3-butyl-urea Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O3S/c1-2-3-8-14-12(16)15-19(17,18)11-6-4-10(9-13)5-7-11/h4-7H,2-3,8-9,13H2,1H3,(H2,14,15,16)