N-[(4-butoxyphenyl)carbamothioyl]-4-tert-butyl-benzamide

Systemtic Name: N-[(4-butoxyphenyl)carbamothioyl]-4-tert-butyl-benzamide Openeye Name: N-[(4-butoxyphenyl)carbamothioyl]-4-tert-butyl-benzamide CAS Name: N-[(4-butoxyanilino)-sulfanylidenemethyl]-4-tert-butylbenzamide IUPAC Name: N-[(4-butoxyphenyl)carbamothioyl]-4-tert-butylbenzamide Traditional Name: N-[(4-butoxyphenyl)thiocarbamoyl]-4-tert-butyl-benzamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H28N2O2S/c1-5-6-15-26-19-13-11-18(12-14-19)23-21(27)24-20(25)16-7-9-17(10-8-16)22(2,3)4/h7-14H,5-6,15H2,1-4H3,(H2,23,24,25,27)