2-[4-[(4-fluorophenyl)sulfonylamino]-3,4-dihydro-2H-chromen-8-yl]ethanethioic S-acid

Systemtic Name: 2-[4-[(4-fluorophenyl)sulfonylamino]-3,4-dihydro-2H-chromen-8-yl]ethanethioic S-acid Openeye Name: 2-[4-[(4-fluorophenyl)sulfonylamino]chroman-8-yl]ethanethioic S-acid CAS Name: 2-[4-[(4-fluorophenyl)sulfonylamino]-3,4-dihydro-2H-1-benzopyran-8-yl]ethanethioic S-acid IUPAC Name: 2-[4-[(4-fluorophenyl)sulfonylamino]-3,4-dihydro-2H-chromen-8-yl]ethanethioic S-acid Traditional Name: 2-[4-[(4-fluorophenyl)sulfonylamino]chroman-8-yl]thioacetic acid Formula: C17H16FNO4S2 MolecularWeight: 381.441643

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C1NS(=O)(=O)C3=CC=C(C=C3)F)C=CC=C2CC(=O)S

Isomeric SMILES

C1COC2=C(C1NS(=O)(=O)C3=CC=C(C=C3)F)C=CC=C2CC(=O)S

InChI

InChI=1S/C17H16FNO4S2/c18-12-4-6-13(7-5-12)25(21,22)19-15-8-9-23-17-11(10-16(20)24)2-1-3-14(15)17/h1-7,15,19H,8-10H2,(H,20,24)