2-[2-(7-chloranylindol-1-yl)ethanoyl]-N-(1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide

Systemtic Name: 2-[2-(7-chloranylindol-1-yl)ethanoyl]-N-(1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: 2-[2-(7-chloroindol-1-yl)acetyl]-N-thiazol-2-yl-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: 2-[2-(7-chloro-1-indolyl)-1-oxoethyl]-N-(2-thiazolyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: 2-[2-(7-chloroindol-1-yl)acetyl]-N-(1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: 2-[2-(7-chloroindol-1-yl)acetyl]-N-thiazol-2-yl-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C22H19ClN4O3S2 MolecularWeight: 486.99426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)S(=O)(=O)NC3=NC=CS3)C(=O)CN4C=CC5=C4C(=CC=C5)Cl

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)S(=O)(=O)NC3=NC=CS3)C(=O)CN4C=CC5=C4C(=CC=C5)Cl

InChI

InChI=1S/C22H19ClN4O3S2/c23-19-3-1-2-16-7-10-27(21(16)19)14-20(28)26-9-6-15-4-5-18(12-17(15)13-26)32(29,30)25-22-24-8-11-31-22/h1-5,7-8,10-12H,6,9,13-14H2,(H,24,25)