N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 2-isopropoxy-N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: 2-isopropoxy-N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)OC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27N3O4S2/c1-16(2)29-20-9-5-4-8-19(20)21(26)24-22(30)23-17-10-12-18(13-11-17)31(27,28)25-14-6-3-7-15-25/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3,(H2,23,24,26,30)