1-(1,3-benzodioxol-5-yl)-3-(4-bromanyl-2-ethyl-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-bromanyl-2-ethyl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-bromo-2-ethyl-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-bromo-2-ethylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-bromo-2-ethylphenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-bromo-2-ethyl-phenyl)thiourea Formula: C16H15BrN2O2S MolecularWeight: 379.2715

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H15BrN2O2S/c1-2-10-7-11(17)3-5-13(10)19-16(22)18-12-4-6-14-15(8-12)21-9-20-14/h3-8H,2,9H2,1H3,(H2,18,19,22)