2-pentoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-pentoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[(4-anilinophenyl)thiocarbamoyl]benzamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O2S/c1-2-3-9-18-30-23-13-8-7-12-22(23)24(29)28-25(31)27-21-16-14-20(15-17-21)26-19-10-5-4-6-11-19/h4-8,10-17,26H,2-3,9,18H2,1H3,(H2,27,28,29,31)