N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide Openeye Name: N-[(4S)-8-fluorothiochroman-4-yl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propanamide CAS Name: N-[(4S)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-(1-propyl-5-sulfamoyl-2-benzimidazolyl)propanamide IUPAC Name: N-[(4S)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-3-(1-propyl-5-sulfamoylbenzimidazol-2-yl)propanamide Traditional Name: N-[(4S)-8-fluorothiochroman-4-yl]-3-(1-propyl-5-sulfamoyl-benzimidazol-2-yl)propionamide Formula: C22H25FN4O3S2 MolecularWeight: 476.587303

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)NC3CCSC4=C3C=CC=C4F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CCC(=O)N[C@H]3CCSC4=C3C=CC=C4F

InChI

InChI=1S/C22H25FN4O3S2/c1-2-11-27-19-7-6-14(32(24,29)30)13-18(19)25-20(27)8-9-21(28)26-17-10-12-31-22-15(17)4-3-5-16(22)23/h3-7,13,17H,2,8-12H2,1H3,(H,26,28)(H2,24,29,30)/t17-/m0/s1