1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-furylmethyl)thiourea CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-furanylmethyl)thiourea IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(2-furfuryl)thiourea Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=S)NCC3=CC=CO3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=S)NCC3=CC=CO3)OC1

InChI

InChI=1S/C15H16N2O3S/c21-15(16-10-12-3-1-6-18-12)17-11-4-5-13-14(9-11)20-8-2-7-19-13/h1,3-6,9H,2,7-8,10H2,(H2,16,17,21)