1-(5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-phenethyl-urea

Systemtic Name: 1-(5-bromanyl-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-phenethyl-urea Openeye Name: 1-(5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-phenethyl-urea CAS Name: 1-[5-bromo-3-(1-pyrrolidinylsulfonyl)-1H-indol-2-yl]-3-phenethylurea IUPAC Name: 1-(5-bromo-3-pyrrolidin-1-ylsulfonyl-1H-indol-2-yl)-3-phenethylurea Traditional Name: 1-(5-bromo-3-pyrrolidinosulfonyl-1H-indol-2-yl)-3-phenethyl-urea Formula: C21H23BrN4O3S MolecularWeight: 491.40132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)NC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(NC3=C2C=C(C=C3)Br)NC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H23BrN4O3S/c22-16-8-9-18-17(14-16)19(30(28,29)26-12-4-5-13-26)20(24-18)25-21(27)23-11-10-15-6-2-1-3-7-15/h1-3,6-9,14,24H,4-5,10-13H2,(H2,23,25,27)