N-[(4-tert-butylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(4-tert-butylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(4-tert-butylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(4-tert-butylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(4-tert-butylphenyl)thiocarbamoyl]-piperonylamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-19(2,3)13-5-7-14(8-6-13)20-18(25)21-17(22)12-4-9-15-16(10-12)24-11-23-15/h4-10H,11H2,1-3H3,(H2,20,21,22,25)