3-butoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(3-heptoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(3-heptoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(3-heptoxyphenyl)thiocarbamoyl]benzamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCCC

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCCC

InChI

InChI=1S/C25H34N2O3S/c1-3-5-7-8-9-17-30-23-15-11-13-21(19-23)26-25(31)27-24(28)20-12-10-14-22(18-20)29-16-6-4-2/h10-15,18-19H,3-9,16-17H2,1-2H3,(H2,26,27,28,31)