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

Systemtic Name: N-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(4-isobutylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[[5-methyl-4-[4-(2-methylpropyl)phenyl]-2-thiazolyl]amino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-(4-isobutylphenyl)-5-methyl-thiazol-2-yl]thiocarbamoyl]-4-propoxy-benzamide Formula: C25H29N3O2S2 MolecularWeight: 467.64666

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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)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S2/c1-5-14-30-21-12-10-20(11-13-21)23(29)27-24(31)28-25-26-22(17(4)32-25)19-8-6-18(7-9-19)15-16(2)3/h6-13,16H,5,14-15H2,1-4H3,(H2,26,27,28,29,31)