1-butyl-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea

Systemtic Name: 1-butyl-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Openeye Name: 1-butyl-3-[3-(p-tolylsulfonyl)propanoylamino]thiourea CAS Name: 1-butyl-3-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]thiourea IUPAC Name: 1-butyl-3-[3-(4-methylphenyl)sulfonylpropanoylamino]thiourea Traditional Name: 1-butyl-3-(3-tosylpropanoylamino)thiourea Formula: C15H23N3O3S2 MolecularWeight: 357.49142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCNC(=S)NNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C15H23N3O3S2/c1-3-4-10-16-15(22)18-17-14(19)9-11-23(20,21)13-7-5-12(2)6-8-13/h5-8H,3-4,9-11H2,1-2H3,(H,17,19)(H2,16,18,22)