1-(1-benzofuran-2-ylcarbonylamino)-3-(4-butylphenyl)thiourea

Systemtic Name: 1-(1-benzofuran-2-ylcarbonylamino)-3-(4-butylphenyl)thiourea Openeye Name: 1-(benzofuran-2-carbonylamino)-3-(4-butylphenyl)thiourea CAS Name: 1-[[2-benzofuranyl(oxo)methyl]amino]-3-(4-butylphenyl)thiourea IUPAC Name: 1-(1-benzofuran-2-carbonylamino)-3-(4-butylphenyl)thiourea Traditional Name: 1-(benzofuran-2-carbonylamino)-3-(4-butylphenyl)thiourea Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C20H21N3O2S/c1-2-3-6-14-9-11-16(12-10-14)21-20(26)23-22-19(24)18-13-15-7-4-5-8-17(15)25-18/h4-5,7-13H,2-3,6H2,1H3,(H,22,24)(H2,21,23,26)