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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-sec-butylphenyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-butan-2-ylphenyl)ethyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-sec-butylphenyl)ethyl]thiourea Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2S/c1-4-13(2)15-5-7-16(8-6-15)14(3)21-20(25)22-17-9-10-18-19(11-17)24-12-23-18/h5-11,13-14H,4,12H2,1-3H3,(H2,21,22,25)