1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(3-bromophenyl)-1-butyl-thiourea

Systemtic Name: 1-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-(3-bromophenyl)-1-butyl-thiourea Openeye Name: 3-(3-bromophenyl)-1-butyl-1-[(3S)-1,1-dioxothiolan-3-yl]thiourea CAS Name: 3-(3-bromophenyl)-1-butyl-1-[(3S)-1,1-dioxo-3-thiolanyl]thiourea IUPAC Name: 3-(3-bromophenyl)-1-butyl-1-[(3S)-1,1-dioxothiolan-3-yl]thiourea Traditional Name: 3-(3-bromophenyl)-1-butyl-1-[(3S)-1,1-diketothiolan-3-yl]thiourea Formula: C15H21BrN2O2S2 MolecularWeight: 405.37344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CCCCN([C@H]1CCS(=O)(=O)C1)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H21BrN2O2S2/c1-2-3-8-18(14-7-9-22(19,20)11-14)15(21)17-13-6-4-5-12(16)10-13/h4-6,10,14H,2-3,7-9,11H2,1H3,(H,17,21)/t14-/m0/s1