1-[4-(2-ethoxyphenoxy)butanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[4-(2-ethoxyphenoxy)butanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[4-(2-ethoxyphenoxy)butanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[4-(2-ethoxyphenoxy)-1-oxobutyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[4-(2-ethoxyphenoxy)butanoylamino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[4-(2-ethoxyphenoxy)butanoylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCCOC2=CC=CC=C2OCC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCCOC2=CC=CC=C2OCC)C

InChI

InChI=1S/C22H29N3O3S/c1-4-17-11-8-10-16(3)21(17)23-22(29)25-24-20(26)14-9-15-28-19-13-7-6-12-18(19)27-5-2/h6-8,10-13H,4-5,9,14-15H2,1-3H3,(H,24,26)(H2,23,25,29)