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

Systemtic Name: N-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[4-(thiophene-2-carbonylamino)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[4-[[oxo(thiophen-2-yl)methyl]amino]anilino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[4-(thiophene-2-carbonylamino)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[4-(2-thenoylamino)phenyl]thiocarbamoyl]-piperonylamide Formula: C20H15N3O4S2 MolecularWeight: 425.4808

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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)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C20H15N3O4S2/c24-18(12-3-8-15-16(10-12)27-11-26-15)23-20(28)22-14-6-4-13(5-7-14)21-19(25)17-2-1-9-29-17/h1-10H,11H2,(H,21,25)(H2,22,23,24,28)