N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: 3-isobutoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: N-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: 3-isobutoxy-N-[[4-(4-methoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23N3O3S2/c1-14(2)12-28-18-6-4-5-16(11-18)20(26)24-21(29)25-22-23-19(13-30-22)15-7-9-17(27-3)10-8-15/h4-11,13-14H,12H2,1-3H3,(H2,23,24,25,26,29)