N-[5-chloranyl-3-(phenylsulfonyl)-1H-indol-2-yl]-2-(pyridin-4-ylmethylamino)ethanamide

Systemtic Name: N-[5-chloranyl-3-(phenylsulfonyl)-1H-indol-2-yl]-2-(pyridin-4-ylmethylamino)ethanamide Openeye Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(4-pyridylmethylamino)acetamide CAS Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(pyridin-4-ylmethylamino)acetamide IUPAC Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(pyridin-4-ylmethylamino)acetamide Traditional Name: N-(3-besyl-5-chloro-1H-indol-2-yl)-2-(4-pyridylmethylamino)acetamide Formula: C22H19ClN4O3S MolecularWeight: 454.92926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)NC(=O)CNCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)NC(=O)CNCC4=CC=NC=C4

InChI

InChI=1S/C22H19ClN4O3S/c23-16-6-7-19-18(12-16)21(31(29,30)17-4-2-1-3-5-17)22(26-19)27-20(28)14-25-13-15-8-10-24-11-9-15/h1-12,25-26H,13-14H2,(H,27,28)