N-[(3-heptoxyphenyl)carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[(3-heptoxyphenyl)carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[(3-heptoxyphenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[(3-heptoxyanilino)-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[(3-heptoxyphenyl)carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[(3-heptoxyphenyl)thiocarbamoyl]benzamide Formula: C26H36N2O3S MolecularWeight: 456.64064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N2O3S/c1-3-5-7-8-10-19-31-24-13-11-12-22(20-24)27-26(32)28-25(29)21-14-16-23(17-15-21)30-18-9-6-4-2/h11-17,20H,3-10,18-19H2,1-2H3,(H2,27,28,29,32)