N-[[4-(oxolan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: N-[[4-(oxolan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-propoxy-benzamide Openeye Name: 2-propoxy-N-[[4-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[oxo-(2-oxolanylmethylamino)methyl]anilino]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: N-[[4-(oxolan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-propoxybenzamide Traditional Name: 2-propoxy-N-[[4-(tetrahydrofurfurylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3CCCO3

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C23H27N3O4S/c1-2-13-30-20-8-4-3-7-19(20)22(28)26-23(31)25-17-11-9-16(10-12-17)21(27)24-15-18-6-5-14-29-18/h3-4,7-12,18H,2,5-6,13-15H2,1H3,(H,24,27)(H2,25,26,28,31)