2-[(4-cyanophenyl)methylsulfonyl]-N-(3,4-dihydro-2H-thiochromen-4-yl)ethanamide

Systemtic Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-(3,4-dihydro-2H-thiochromen-4-yl)ethanamide Openeye Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-thiochroman-4-yl-acetamide CAS Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)acetamide IUPAC Name: 2-[(4-cyanophenyl)methylsulfonyl]-N-(3,4-dihydro-2H-thiochromen-4-yl)acetamide Traditional Name: 2-(4-cyanobenzyl)sulfonyl-N-thiochroman-4-yl-acetamide Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CS(=O)(=O)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CS(=O)(=O)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H18N2O3S2/c20-11-14-5-7-15(8-6-14)12-26(23,24)13-19(22)21-17-9-10-25-18-4-2-1-3-16(17)18/h1-8,17H,9-10,12-13H2,(H,21,22)