1-(3-bromophenyl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-thiourea

Systemtic Name: 1-(3-bromophenyl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-thiourea Openeye Name: 1-(3-bromophenyl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-thiourea CAS Name: 1-(3-bromophenyl)-3-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)thiourea IUPAC Name: 1-(3-bromophenyl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylthiourea Traditional Name: 1-(3-bromophenyl)-3-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-thiourea Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=S)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=S)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C18H17BrN2O2S/c19-12-4-3-5-13(10-12)20-17(24)21-14-6-7-15-16(11-14)23-18(22-15)8-1-2-9-18/h3-7,10-11H,1-2,8-9H2,(H2,20,21,24)