1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)propyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)propyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-sec-butylphenyl)propyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)propyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)propyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-sec-butylphenyl)propyl]thiourea Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2S/c1-4-14(3)15-6-8-16(9-7-15)18(5-2)23-21(26)22-17-10-11-19-20(12-17)25-13-24-19/h6-12,14,18H,4-5,13H2,1-3H3,(H2,22,23,26)