1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea

Systemtic Name: 1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea Openeye Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea CAS Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea IUPAC Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea Traditional Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-(2-fluorophenyl)thiourea Formula: C17H16ClFN2O2S MolecularWeight: 366.837543

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=S)NC3=CC=CC=C3F)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=S)NC3=CC=CC=C3F)Cl)OC1

InChI

InChI=1S/C17H16ClFN2O2S/c18-12-8-11(9-15-16(12)23-7-3-6-22-15)10-20-17(24)21-14-5-2-1-4-13(14)19/h1-2,4-5,8-9H,3,6-7,10H2,(H2,20,21,24)