1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea

Systemtic Name: 1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea CAS Name: 1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]thiourea Formula: C13H17BrN2O2S MolecularWeight: 345.25528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CNC(=S)NC2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1(OCC(O1)CNC(=S)NC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C13H17BrN2O2S/c1-13(2)17-8-11(18-13)7-15-12(19)16-10-5-3-9(14)4-6-10/h3-6,11H,7-8H2,1-2H3,(H2,15,16,19)