2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(1H-imidazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CN=CN4

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CN=CN4

InChI

InChI=1S/C21H21FN4O3S/c22-17-5-7-19(8-6-17)30(28,29)26-13-16-4-2-1-3-15(16)11-20(26)21(27)24-10-9-18-12-23-14-25-18/h1-8,12,14,20H,9-11,13H2,(H,23,25)(H,24,27)