N-[(2-propan-2-ylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2-propan-2-ylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2-isopropylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2-propan-2-ylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(o-cumenylthiocarbamoyl)-piperonylamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O3S/c1-11(2)13-5-3-4-6-14(13)19-18(24)20-17(21)12-7-8-15-16(9-12)23-10-22-15/h3-9,11H,10H2,1-2H3,(H2,19,20,21,24)