1-[(4-fluorophenyl)methyl]-3-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]thiourea Formula: C18H18FN3O4S MolecularWeight: 391.416623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3O4S/c1-24-14-8-12(9-15-16(14)26-7-6-25-15)17(23)21-22-18(27)20-10-11-2-4-13(19)5-3-11/h2-5,8-9H,6-7,10H2,1H3,(H,21,23)(H2,20,22,27)