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

Systemtic Name: N-[5-chloranyl-3-(phenylsulfonyl)-1H-indol-2-yl]-2-(1,3-thiazol-4-ylmethylamino)ethanamide Openeye Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(thiazol-4-ylmethylamino)acetamide CAS Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(4-thiazolylmethylamino)acetamide IUPAC Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-(1,3-thiazol-4-ylmethylamino)acetamide Traditional Name: N-(3-besyl-5-chloro-1H-indol-2-yl)-2-(thiazol-4-ylmethylamino)acetamide Formula: C20H17ClN4O3S2 MolecularWeight: 460.95698

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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=CSC=N4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Cl)NC(=O)CNCC4=CSC=N4

InChI

InChI=1S/C20H17ClN4O3S2/c21-13-6-7-17-16(8-13)19(30(27,28)15-4-2-1-3-5-15)20(24-17)25-18(26)10-22-9-14-11-29-12-23-14/h1-8,11-12,22,24H,9-10H2,(H,25,26)