4-heptoxy-N-[(4-hydroxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[(4-hydroxyphenyl)carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[(4-hydroxyphenyl)carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[(4-hydroxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[(4-hydroxyphenyl)carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[(4-hydroxyphenyl)thiocarbamoyl]benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)O

InChI

InChI=1S/C21H26N2O3S/c1-2-3-4-5-6-15-26-19-13-7-16(8-14-19)20(25)23-21(27)22-17-9-11-18(24)12-10-17/h7-14,24H,2-6,15H2,1H3,(H2,22,23,25,27)