1-butyl-3-(4-ethoxy-2-methyl-phenyl)sulfonyl-thiourea

Systemtic Name: 1-butyl-3-(4-ethoxy-2-methyl-phenyl)sulfonyl-thiourea Openeye Name: 1-butyl-3-(4-ethoxy-2-methyl-phenyl)sulfonyl-thiourea CAS Name: 1-butyl-3-(4-ethoxy-2-methylphenyl)sulfonylthiourea IUPAC Name: 1-butyl-3-(4-ethoxy-2-methylphenyl)sulfonylthiourea Traditional Name: 1-butyl-3-(4-ethoxy-2-methyl-phenyl)sulfonyl-thiourea Formula: C14H22N2O3S2 MolecularWeight: 330.46608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NS(=O)(=O)C1=C(C=C(C=C1)OCC)C

Isomeric SMILES

CCCCNC(=S)NS(=O)(=O)C1=C(C=C(C=C1)OCC)C

InChI

InChI=1S/C14H22N2O3S2/c1-4-6-9-15-14(20)16-21(17,18)13-8-7-12(19-5-2)10-11(13)3/h7-8,10H,4-6,9H2,1-3H3,(H2,15,16,20)