4-pentoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-pentoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-isopropoxyphenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: 4-pentoxy-N-[(4-propan-2-yloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-pentoxy-N-[(4-propan-2-yloxyphenyl)carbamothioyl]benzamide Traditional Name: 4-amoxy-N-[(4-isopropoxyphenyl)thiocarbamoyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C22H28N2O3S/c1-4-5-6-15-26-19-11-7-17(8-12-19)21(25)24-22(28)23-18-9-13-20(14-10-18)27-16(2)3/h7-14,16H,4-6,15H2,1-3H3,(H2,23,24,25,28)