4-butoxy-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[4-(p-tolyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[[4-(4-methylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[4-(p-tolyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H23N3O2S2/c1-3-4-13-27-18-11-9-17(10-12-18)20(26)24-21(28)25-22-23-19(14-29-22)16-7-5-15(2)6-8-16/h5-12,14H,3-4,13H2,1-2H3,(H2,23,24,25,26,28)