N-[(6-pentoxypyridin-3-yl)carbamothioyl]-1,3-benzoxazole-2-carboxamide

Systemtic Name: N-[(6-pentoxypyridin-3-yl)carbamothioyl]-1,3-benzoxazole-2-carboxamide Openeye Name: N-[(6-pentoxy-3-pyridyl)carbamothioyl]-1,3-benzoxazole-2-carboxamide CAS Name: N-[[(6-pentoxy-3-pyridinyl)amino]-sulfanylidenemethyl]-1,3-benzoxazole-2-carboxamide IUPAC Name: N-[(6-pentoxypyridin-3-yl)carbamothioyl]-1,3-benzoxazole-2-carboxamide Traditional Name: N-[(6-amoxy-3-pyridyl)thiocarbamoyl]-1,3-benzoxazole-2-carboxamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NC=C(C=C1)NC(=S)NC(=O)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CCCCCOC1=NC=C(C=C1)NC(=S)NC(=O)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H20N4O3S/c1-2-3-6-11-25-16-10-9-13(12-20-16)21-19(27)23-17(24)18-22-14-7-4-5-8-15(14)26-18/h4-5,7-10,12H,2-3,6,11H2,1H3,(H2,21,23,24,27)