1-(4-ethylphenyl)-3-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]thiourea

Systemtic Name: 1-(4-ethylphenyl)-3-[[5-(phenoxymethyl)furan-2-yl]carbonylamino]thiourea Openeye Name: 1-(4-ethylphenyl)-3-[[5-(phenoxymethyl)furan-2-carbonyl]amino]thiourea CAS Name: 1-(4-ethylphenyl)-3-[[oxo-[5-(phenoxymethyl)-2-furanyl]methyl]amino]thiourea IUPAC Name: 1-(4-ethylphenyl)-3-[[5-(phenoxymethyl)furan-2-carbonyl]amino]thiourea Traditional Name: 1-(4-ethylphenyl)-3-[[5-(phenoxymethyl)-2-furoyl]amino]thiourea Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(O2)COC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=C(O2)COC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-2-15-8-10-16(11-9-15)22-21(28)24-23-20(25)19-13-12-18(27-19)14-26-17-6-4-3-5-7-17/h3-13H,2,14H2,1H3,(H,23,25)(H2,22,24,28)