N-[(3-butoxyphenyl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(3-butoxyphenyl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[(3-butoxyphenyl)carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[(3-butoxyanilino)-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(3-butoxyphenyl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(3-butoxyphenyl)thiocarbamoyl]-4-isopropyl-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2S/c1-4-5-13-25-19-8-6-7-18(14-19)22-21(26)23-20(24)17-11-9-16(10-12-17)15(2)3/h6-12,14-15H,4-5,13H2,1-3H3,(H2,22,23,24,26)