2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-(2-ethanoyl-1-benzofuran-5-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-N-(2-ethanoyl-1-benzofuran-5-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(2-acetylbenzofuran-5-yl)-2-[1-[(4-dimethylaminophenyl)carbamothioyl]-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(2-acetyl-5-benzofuranyl)-2-[1-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2-acetyl-1-benzofuran-5-yl)-2-[1-[(4-dimethylaminophenyl)carbamothioyl]piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(2-acetylbenzofuran-5-yl)-2-[1-[(4-dimethylaminophenyl)thiocarbamoyl]-4-piperidyl]thiazole-4-carboxamide Formula: C28H29N5O3S2 MolecularWeight: 547.69156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=S)NC5=CC=C(C=C5)N(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=S)NC5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C28H29N5O3S2/c1-17(34)25-15-19-14-21(6-9-24(19)36-25)29-26(35)23-16-38-27(31-23)18-10-12-33(13-11-18)28(37)30-20-4-7-22(8-5-20)32(2)3/h4-9,14-16,18H,10-13H2,1-3H3,(H,29,35)(H,30,37)