1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-butylphenyl)thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O2S/c1-2-3-4-13-5-7-14(8-6-13)19-18(23)20-15-9-10-16-17(11-15)22-12-21-16/h5-11H,2-4,12H2,1H3,(H2,19,20,23)