5-bromanyl-N-(1,2-oxazol-3-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide

Systemtic Name: 5-bromanyl-N-(1,2-oxazol-3-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide Openeye Name: 5-bromo-N-(isoxazol-3-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide CAS Name: 5-bromo-N-(3-isoxazolylmethyl)-3-(1-pyrrolidinylsulfonyl)-1H-indole-2-carboxamide IUPAC Name: 5-bromo-N-(1,2-oxazol-3-ylmethyl)-3-pyrrolidin-1-ylsulfonyl-1H-indole-2-carboxamide Traditional Name: 5-bromo-N-(isoxazol-3-ylmethyl)-3-pyrrolidinosulfonyl-1H-indole-2-carboxamide Formula: C17H17BrN4O4S MolecularWeight: 453.31028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)NCC4=NOC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)NCC4=NOC=C4

InChI

InChI=1S/C17H17BrN4O4S/c18-11-3-4-14-13(9-11)16(27(24,25)22-6-1-2-7-22)15(20-14)17(23)19-10-12-5-8-26-21-12/h3-5,8-9,20H,1-2,6-7,10H2,(H,19,23)