N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[[4-(4-chlorophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]thiocarbamoyl]-4-isopropyl-benzamide Formula: C20H18ClN3OS2 MolecularWeight: 415.95942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClN3OS2/c1-12(2)13-3-5-15(6-4-13)18(25)23-19(26)24-20-22-17(11-27-20)14-7-9-16(21)10-8-14/h3-12H,1-2H3,(H2,22,23,24,25,26)