N-[(4-pentoxyphenyl)carbamothioyl]-2,1,3-benzoxadiazole-5-carboxamide

Systemtic Name: N-[(4-pentoxyphenyl)carbamothioyl]-2,1,3-benzoxadiazole-5-carboxamide Openeye Name: N-[(4-pentoxyphenyl)carbamothioyl]-2,1,3-benzoxadiazole-5-carboxamide CAS Name: N-[(4-pentoxyanilino)-sulfanylidenemethyl]-2,1,3-benzoxadiazole-5-carboxamide IUPAC Name: N-[(4-pentoxyphenyl)carbamothioyl]-2,1,3-benzoxadiazole-5-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]benzofurazan-5-carboxamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=NON=C3C=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=NON=C3C=C2

InChI

InChI=1S/C19H20N4O3S/c1-2-3-4-11-25-15-8-6-14(7-9-15)20-19(27)21-18(24)13-5-10-16-17(12-13)23-26-22-16/h5-10,12H,2-4,11H2,1H3,(H2,20,21,24,27)