1-(4-butylphenyl)-3-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[3-(ethoxymethyl)-1-benzofuran-2-yl]carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[3-(ethoxymethyl)benzofuran-2-carbonyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[[3-(ethoxymethyl)-2-benzofuranyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[3-(ethoxymethyl)-1-benzofuran-2-carbonyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[3-(ethoxymethyl)benzofuran-2-carbonyl]amino]thiourea Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3O2)COCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C3=CC=CC=C3O2)COCC

InChI

InChI=1S/C23H27N3O3S/c1-3-5-8-16-11-13-17(14-12-16)24-23(30)26-25-22(27)21-19(15-28-4-2)18-9-6-7-10-20(18)29-21/h6-7,9-14H,3-5,8,15H2,1-2H3,(H,25,27)(H2,24,26,30)