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

Systemtic Name: 4-pentoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Openeye Name: N-[(2-isopropylphenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: 4-pentoxy-N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-pentoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-amoxy-N-(o-cumenylthiocarbamoyl)benzamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(C)C

InChI

InChI=1S/C22H28N2O2S/c1-4-5-8-15-26-18-13-11-17(12-14-18)21(25)24-22(27)23-20-10-7-6-9-19(20)16(2)3/h6-7,9-14,16H,4-5,8,15H2,1-3H3,(H2,23,24,25,27)