N-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(4-isopropylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[[5-methyl-4-(4-propan-2-ylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[(5-methyl-4-p-cumenyl-thiazol-2-yl)thiocarbamoyl]-4-propoxy-benzamide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(S2)C)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(S2)C)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C24H27N3O2S2/c1-5-14-29-20-12-10-19(11-13-20)22(28)26-23(30)27-24-25-21(16(4)31-24)18-8-6-17(7-9-18)15(2)3/h6-13,15H,5,14H2,1-4H3,(H2,25,26,27,28,30)