[1,1-bis(oxidanylidene)thiolan-3-yl]-[4-(3-bromanyl-1-methyl-indol-2-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: [1,1-bis(oxidanylidene)thiolan-3-yl]-[4-(3-bromanyl-1-methyl-indol-2-yl)carbonylpiperazin-1-yl]methanone Openeye Name: [4-(3-bromo-1-methyl-indole-2-carbonyl)piperazin-1-yl]-(1,1-dioxothiolan-3-yl)methanone CAS Name: [4-[(3-bromo-1-methyl-2-indolyl)-oxomethyl]-1-piperazinyl]-(1,1-dioxo-3-thiolanyl)methanone IUPAC Name: [4-(3-bromo-1-methylindole-2-carbonyl)piperazin-1-yl]-(1,1-dioxothiolan-3-yl)methanone Traditional Name: [4-(3-bromo-1-methyl-indole-2-carbonyl)piperazino]-(1,1-diketothiolan-3-yl)methanone Formula: C19H22BrN3O4S MolecularWeight: 468.36468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)N3CCN(CC3)C(=O)C4CCS(=O)(=O)C4)Br

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)N3CCN(CC3)C(=O)C4CCS(=O)(=O)C4)Br

InChI

InChI=1S/C19H22BrN3O4S/c1-21-15-5-3-2-4-14(15)16(20)17(21)19(25)23-9-7-22(8-10-23)18(24)13-6-11-28(26,27)12-13/h2-5,13H,6-12H2,1H3