N-[[4-(2-phenylethanoylamino)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[4-(2-phenylethanoylamino)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[4-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[4-[(1-oxo-2-phenylethyl)amino]anilino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[4-[(2-phenylacetyl)amino]phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[4-[(2-phenylacetyl)amino]phenyl]thiocarbamoyl]-piperonylamide Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H19N3O4S/c27-21(12-15-4-2-1-3-5-15)24-17-7-9-18(10-8-17)25-23(31)26-22(28)16-6-11-19-20(13-16)30-14-29-19/h1-11,13H,12,14H2,(H,24,27)(H2,25,26,28,31)